; LLVM IR from Mjolnir-MD/Mjolnir :: test/core/test_lennard_jones_attractive_potential.ll (ZN16LJ_cutoff_length11test_methodEv)

; Unoptimized IR (clang -disable-llvm-passes):
target datalayout = "e-m:e-p270:32:32-p271:32:32-p272:64:64-i64:64-i128:128-f80:128-n8:16:32:64-S128"
target triple = "x86_64-unknown-linux-gnu"

%"class.boost::test_tools::assertion::value_expr" = type { double }
%"class.boost::test_tools::assertion::binary_expr" = type { %"class.boost::test_tools::assertion::value_expr", double }
%"class.boost::unit_test::lazy_ostream_impl.320" = type { %"class.boost::unit_test::lazy_ostream.base", ptr, ptr }
%"class.boost::unit_test::lazy_ostream.base" = type <{ ptr, i8 }>
%"class.mjolnir::LennardJonesAttractivePotential" = type { double, double }
%"class.std::vector.329" = type { %"struct.std::_Vector_base.330" }
%"struct.std::_Vector_base.330" = type { %"struct.std::_Vector_base<std::pair<unsigned long, mjolnir::LennardJonesAttractivePotential<double>::parameter_type>, std::allocator<std::pair<unsigned long, mjolnir::LennardJonesAttractivePotential<double>::parameter_type>>>::_Vector_impl" }
%"struct.std::_Vector_base<std::pair<unsigned long, mjolnir::LennardJonesAttractivePotential<double>::parameter_type>, std::allocator<std::pair<unsigned long, mjolnir::LennardJonesAttractivePotential<double>::parameter_type>>>::_Vector_impl" = type { %"struct.std::_Vector_base<std::pair<unsigned long, mjolnir::LennardJonesAttractivePotential<double>::parameter_type>, std::allocator<std::pair<unsigned long, mjolnir::LennardJonesAttractivePotential<double>::parameter_type>>>::_Vector_impl_data" }
%"struct.std::_Vector_base<std::pair<unsigned long, mjolnir::LennardJonesAttractivePotential<double>::parameter_type>, std::allocator<std::pair<unsigned long, mjolnir::LennardJonesAttractivePotential<double>::parameter_type>>>::_Vector_impl_data" = type { ptr, ptr, ptr }
%"class.std::allocator.331" = type { i8 }
%"class.mjolnir::LorentzBerthelotRule" = type { %"struct.mjolnir::ParameterListBase", double, %"class.std::vector.7", %"class.std::vector.336", %"class.mjolnir::ExclusionList" }
%"struct.mjolnir::ParameterListBase" = type { ptr }
%"class.std::vector.7" = type { %"struct.std::_Vector_base.8" }
%"struct.std::_Vector_base.8" = type { %"struct.std::_Vector_base<unsigned long, std::allocator<unsigned long>>::_Vector_impl" }
%"struct.std::_Vector_base<unsigned long, std::allocator<unsigned long>>::_Vector_impl" = type { %"struct.std::_Vector_base<unsigned long, std::allocator<unsigned long>>::_Vector_impl_data" }
%"struct.std::_Vector_base<unsigned long, std::allocator<unsigned long>>::_Vector_impl_data" = type { ptr, ptr, ptr }
%"class.std::vector.336" = type { %"struct.std::_Vector_base.337" }
%"struct.std::_Vector_base.337" = type { %"struct.std::_Vector_base<mjolnir::LennardJonesAttractivePotential<double>::parameter_type, std::allocator<mjolnir::LennardJonesAttractivePotential<double>::parameter_type>>::_Vector_impl" }
%"struct.std::_Vector_base<mjolnir::LennardJonesAttractivePotential<double>::parameter_type, std::allocator<mjolnir::LennardJonesAttractivePotential<double>::parameter_type>>::_Vector_impl" = type { %"struct.std::_Vector_base<mjolnir::LennardJonesAttractivePotential<double>::parameter_type, std::allocator<mjolnir::LennardJonesAttractivePotential<double>::parameter_type>>::_Vector_impl_data" }
%"struct.std::_Vector_base<mjolnir::LennardJonesAttractivePotential<double>::parameter_type, std::allocator<mjolnir::LennardJonesAttractivePotential<double>::parameter_type>>::_Vector_impl_data" = type { ptr, ptr, ptr }
%"class.mjolnir::ExclusionList" = type { %"class.mjolnir::IgnoreMolecule", %"class.mjolnir::IgnoreGroup", %"class.std::vector.348", %"class.std::vector.7", %"class.std::vector", %"class.std::vector.7", %"class.std::vector.7", %"class.std::vector.353", %"class.std::vector.7", %"class.std::vector.353", %"class.std::vector.7", %"class.std::vector.353" }
%"class.mjolnir::IgnoreMolecule" = type { %"class.std::unique_ptr" }
%"class.std::unique_ptr" = type { %"struct.std::__uniq_ptr_data" }
%"struct.std::__uniq_ptr_data" = type { %"class.std::__uniq_ptr_impl" }
%"class.std::__uniq_ptr_impl" = type { %"class.std::tuple" }
%"class.std::tuple" = type { %"struct.std::_Tuple_impl" }
%"struct.std::_Tuple_impl" = type { %"struct.std::_Head_base.342" }
%"struct.std::_Head_base.342" = type { ptr }
%"class.mjolnir::IgnoreGroup" = type { %"class.std::map.343", %"class.std::vector" }
%"class.std::map.343" = type { %"class.std::_Rb_tree.344" }
%"class.std::_Rb_tree.344" = type { %"struct.std::_Rb_tree<std::__cxx11::basic_string<char>, std::pair<const std::__cxx11::basic_string<char>, std::vector<std::__cxx11::basic_string<char>>>, std::_Select1st<std::pair<const std::__cxx11::basic_string<char>, std::vector<std::__cxx11::basic_string<char>>>>, std::less<std::__cxx11::basic_string<char>>>::_Rb_tree_impl" }
%"struct.std::_Rb_tree<std::__cxx11::basic_string<char>, std::pair<const std::__cxx11::basic_string<char>, std::vector<std::__cxx11::basic_string<char>>>, std::_Select1st<std::pair<const std::__cxx11::basic_string<char>, std::vector<std::__cxx11::basic_string<char>>>>, std::less<std::__cxx11::basic_string<char>>>::_Rb_tree_impl" = type { [8 x i8], %"struct.std::_Rb_tree_header" }
%"struct.std::_Rb_tree_header" = type { %"struct.std::_Rb_tree_node_base", i64 }
%"struct.std::_Rb_tree_node_base" = type { i32, ptr, ptr, ptr }
%"class.std::vector.348" = type { %"struct.std::_Vector_base.349" }
%"struct.std::_Vector_base.349" = type { %"struct.std::_Vector_base<std::pair<std::__cxx11::basic_string<char>, unsigned long>, std::allocator<std::pair<std::__cxx11::basic_string<char>, unsigned long>>>::_Vector_impl" }
%"struct.std::_Vector_base<std::pair<std::__cxx11::basic_string<char>, unsigned long>, std::allocator<std::pair<std::__cxx11::basic_string<char>, unsigned long>>>::_Vector_impl" = type { %"struct.std::_Vector_base<std::pair<std::__cxx11::basic_string<char>, unsigned long>, std::allocator<std::pair<std::__cxx11::basic_string<char>, unsigned long>>>::_Vector_impl_data" }
%"struct.std::_Vector_base<std::pair<std::__cxx11::basic_string<char>, unsigned long>, std::allocator<std::pair<std::__cxx11::basic_string<char>, unsigned long>>>::_Vector_impl_data" = type { ptr, ptr, ptr }
%"class.std::vector" = type { %"struct.std::_Vector_base" }
%"struct.std::_Vector_base" = type { %"struct.std::_Vector_base<std::__cxx11::basic_string<char>, std::allocator<std::__cxx11::basic_string<char>>>::_Vector_impl" }
%"struct.std::_Vector_base<std::__cxx11::basic_string<char>, std::allocator<std::__cxx11::basic_string<char>>>::_Vector_impl" = type { %"struct.std::_Vector_base<std::__cxx11::basic_string<char>, std::allocator<std::__cxx11::basic_string<char>>>::_Vector_impl_data" }
%"struct.std::_Vector_base<std::__cxx11::basic_string<char>, std::allocator<std::__cxx11::basic_string<char>>>::_Vector_impl_data" = type { ptr, ptr, ptr }
%"class.std::vector.353" = type { %"struct.std::_Vector_base.354" }
%"struct.std::_Vector_base.354" = type { %"struct.std::_Vector_base<std::pair<unsigned long, unsigned long>, std::allocator<std::pair<unsigned long, unsigned long>>>::_Vector_impl" }
%"struct.std::_Vector_base<std::pair<unsigned long, unsigned long>, std::allocator<std::pair<unsigned long, unsigned long>>>::_Vector_impl" = type { %"struct.std::_Vector_base<std::pair<unsigned long, unsigned long>, std::allocator<std::pair<unsigned long, unsigned long>>>::_Vector_impl_data" }
%"struct.std::_Vector_base<std::pair<unsigned long, unsigned long>, std::allocator<std::pair<unsigned long, unsigned long>>>::_Vector_impl_data" = type { ptr, ptr, ptr }
%"class.std::map.358" = type { %"class.std::_Rb_tree.359" }
%"class.std::_Rb_tree.359" = type { %"struct.std::_Rb_tree<std::__cxx11::basic_string<char>, std::pair<const std::__cxx11::basic_string<char>, unsigned long>, std::_Select1st<std::pair<const std::__cxx11::basic_string<char>, unsigned long>>, std::less<std::__cxx11::basic_string<char>>>::_Rb_tree_impl" }
%"struct.std::_Rb_tree<std::__cxx11::basic_string<char>, std::pair<const std::__cxx11::basic_string<char>, unsigned long>, std::_Select1st<std::pair<const std::__cxx11::basic_string<char>, unsigned long>>, std::less<std::__cxx11::basic_string<char>>>::_Rb_tree_impl" = type { [8 x i8], %"struct.std::_Rb_tree_header" }
%"class.std::__cxx11::basic_string" = type { %"struct.std::__cxx11::basic_string<char>::_Alloc_hider", i64, %union.anon }
%"struct.std::__cxx11::basic_string<char>::_Alloc_hider" = type { ptr }
%union.anon = type { i64, [8 x i8] }
%"class.std::allocator" = type { i8 }
%"class.__gnu_cxx::__normal_iterator.363" = type { ptr }
%"struct.mjolnir::LennardJonesAttractivePotential<double>::parameter_type" = type { double, double }
%"class.boost::unit_test::basic_cstring" = type { ptr, ptr }
%"class.boost::test_tools::assertion_result" = type { %"class.boost::test_tools::assertion_result::readonly_property65", %"class.boost::shared_ptr.225" }
%"class.boost::test_tools::assertion_result::readonly_property65" = type { %"class.boost::unit_test::readonly_property.213" }
%"class.boost::unit_test::readonly_property.213" = type { %"class.boost::unit_test::class_property.98" }
%"class.boost::unit_test::class_property.98" = type { i8 }
%"class.boost::shared_ptr.225" = type { ptr, %"class.boost::detail::shared_count" }
%"class.boost::detail::shared_count" = type { ptr }
%"class.boost::test_tools::assertion::binary_expr.364" = type { %"class.boost::test_tools::assertion::value_expr.366", ptr }
%"class.boost::test_tools::assertion::value_expr.366" = type { ptr }
%"class.boost::test_tools::assertion::seed" = type { i8 }
%"struct.std::pair.334" = type { i64, %"struct.mjolnir::LennardJonesAttractivePotential<double>::parameter_type" }

@_ZN5boost9unit_test12_GLOBAL__N_113unit_test_logE = external hidden global ptr, align 8
@.str.401 = external hidden unnamed_addr constant [106 x i8], align 1
@.str.409 = external hidden unnamed_addr constant [8 x i8], align 1
@.str.410 = external hidden unnamed_addr constant [29 x i8], align 1
@.str.411 = external hidden unnamed_addr constant [89 x i8], align 1

; Function Attrs: nocallback nofree nosync nounwind willreturn memory(argmem: readwrite)
declare void @llvm.lifetime.start.p0(i64 immarg, ptr nocapture) #0

declare i32 @__gxx_personality_v0(...)

; Function Attrs: nocallback nofree nosync nounwind willreturn memory(argmem: readwrite)
declare void @llvm.lifetime.end.p0(i64 immarg, ptr nocapture) #0

; Function Attrs: mustprogress nounwind uwtable
declare void @_ZNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEED2Ev(ptr noundef nonnull align 8 dereferenceable(32)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare void @_ZNSaIcEC2Ev(ptr noundef nonnull align 1 dereferenceable(1)) unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEC2IS3_EEPKcRKS3_(ptr noundef nonnull align 8 dereferenceable(32), ptr noundef, ptr noundef nonnull align 1 dereferenceable(1)) unnamed_addr #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16), ptr noundef, i64 noundef) unnamed_addr #1 align 2

; Function Attrs: nocallback nofree nounwind willreturn memory(argmem: write)
declare void @llvm.memset.p0.i64(ptr nocapture writeonly, i8, i64, i1 immarg) #3

; Function Attrs: inlinehint mustprogress nounwind uwtable
declare dso_local void @_ZN5boost9unit_test13basic_cstringIKcEC2Ev(ptr noundef nonnull align 8 dereferenceable(16)) unnamed_addr #4 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local noundef nonnull align 8 dereferenceable(9) ptr @_ZN5boost9unit_test12lazy_ostream8instanceEv() #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local noundef zeroext i1 @_ZN5boost10test_tools9tt_detail16report_assertionERKNS0_16assertion_resultERKNS_9unit_test12lazy_ostreamENS5_13basic_cstringIKcEEmNS1_10tool_levelENS1_10check_typeEmz(ptr noundef nonnull align 8 dereferenceable(24), ptr noundef nonnull align 8 dereferenceable(9), ptr noundef, i64 noundef, i32 noundef, i32 noundef, i64 noundef, ...) #2

; Function Attrs: inlinehint mustprogress nounwind uwtable
declare dso_local void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24)) unnamed_addr #4 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZN5boost9unit_test15unit_test_log_t14set_checkpointENS0_13basic_cstringIKcEEmS4_(ptr noundef nonnull align 8 dereferenceable(8), ptr noundef, i64 noundef, ptr noundef) #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZN7mjolnir31LennardJonesAttractivePotentialIdEC2Ed(ptr noundef nonnull align 8 dereferenceable(16), double noundef) unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZNK5boost10test_tools9assertion4seedpmIdEENS1_10value_exprIT_EEOS5_(ptr dead_on_unwind noalias writable sret(%"class.boost::test_tools::assertion::value_expr") align 8, ptr noundef nonnull align 1 dereferenceable(1), ptr noundef nonnull align 8 dereferenceable(8)) #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local noundef double @_ZNK7mjolnir31LennardJonesAttractivePotentialIdE9potentialEdRKNS1_14parameter_typeE(ptr noundef nonnull align 8 dereferenceable(16), double noundef, ptr noundef nonnull align 8 dereferenceable(16)) #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZN5boost10test_tools9assertion15expression_baseINS1_10value_exprIdEEdEeqIdEENS1_11binary_exprIS4_T_NS1_2op2EQIdNS5_4RhsTIS8_E4typeEvEEEEOS8_(ptr dead_on_unwind noalias writable sret(%"class.boost::test_tools::assertion::binary_expr") align 8, ptr noundef nonnull align 1 dereferenceable(1), ptr noundef nonnull align 8 dereferenceable(8)) #2 align 2

; Function Attrs: inlinehint mustprogress uwtable
declare dso_local void @_ZN5boost9unit_testlsINS0_13basic_cstringIKcEEEENS0_17lazy_ostream_implINS0_12lazy_ostreamET_RKS7_EERKS6_S9_(ptr dead_on_unwind noalias writable sret(%"class.boost::unit_test::lazy_ostream_impl.320") align 8, ptr noundef nonnull align 8 dereferenceable(9), ptr noundef nonnull align 8 dereferenceable(16)) #5

; Function Attrs: inlinehint mustprogress nounwind uwtable
declare dso_local noundef zeroext i1 @_ZN5boost10test_tools9tt_detail10dummy_condEv() #4

; Function Attrs: mustprogress uwtable
define dso_local void @_ZN16LJ_cutoff_length11test_methodEv(ptr noundef nonnull align 1 dereferenceable(1) %0) #2 align 2 personality ptr @__gxx_personality_v0 {
  %2 = alloca ptr, align 8
  %3 = alloca %"class.mjolnir::LennardJonesAttractivePotential", align 8
  %4 = alloca %"class.std::vector.329", align 8
  %5 = alloca %"class.std::allocator.331", align 1
  %6 = alloca ptr, align 8
  %7 = alloca i32, align 4
  %8 = alloca i64, align 8
  %9 = alloca %"class.mjolnir::LorentzBerthelotRule", align 8
  %10 = alloca %"class.std::map.358", align 8
  %11 = alloca %"class.mjolnir::IgnoreMolecule", align 8
  %12 = alloca %"class.std::__cxx11::basic_string", align 8
  %13 = alloca %"class.std::allocator", align 1
  %14 = alloca %"class.mjolnir::IgnoreGroup", align 8
  %15 = alloca %"class.std::map.343", align 8
  %16 = alloca double, align 8
  %17 = alloca %"class.__gnu_cxx::__normal_iterator.363", align 8
  %18 = alloca %"class.__gnu_cxx::__normal_iterator.363", align 8
  %19 = alloca double, align 8
  %20 = alloca i64, align 8
  %21 = alloca i32, align 4
  %22 = alloca i64, align 8
  %23 = alloca double, align 8
  %24 = alloca %"struct.mjolnir::LennardJonesAttractivePotential<double>::parameter_type", align 8
  %25 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %26 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %27 = alloca %"class.boost::test_tools::assertion_result", align 8
  %28 = alloca %"class.boost::test_tools::assertion::binary_expr.364", align 8
  %29 = alloca %"class.boost::test_tools::assertion::value_expr.366", align 8
  %30 = alloca %"class.boost::test_tools::assertion::seed", align 1
  %31 = alloca %"class.boost::unit_test::lazy_ostream_impl.320", align 8
  %32 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %33 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %34 = alloca double, align 8
  %35 = alloca i64, align 8
  %36 = alloca i64, align 8
  %37 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %38 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %39 = alloca %"class.boost::test_tools::assertion_result", align 8
  %40 = alloca %"class.boost::test_tools::assertion::binary_expr", align 8
  %41 = alloca %"class.boost::test_tools::assertion::value_expr", align 8
  %42 = alloca %"class.boost::test_tools::assertion::seed", align 1
  %43 = alloca double, align 8
  %44 = alloca %"struct.mjolnir::LennardJonesAttractivePotential<double>::parameter_type", align 8
  %45 = alloca double, align 8
  %46 = alloca %"class.boost::unit_test::lazy_ostream_impl.320", align 8
  %47 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %48 = alloca %"class.boost::unit_test::basic_cstring", align 8
  store ptr %0, ptr %2, align 8, !tbaa !5
  %49 = load ptr, ptr %2, align 8
  call void @llvm.lifetime.start.p0(i64 16, ptr %3) #6
  call void @_ZN7mjolnir31LennardJonesAttractivePotentialIdEC2Ed(ptr noundef nonnull align 8 dereferenceable(16) %3, double noundef 2.500000e+00) #6
  call void @llvm.lifetime.start.p0(i64 24, ptr %4) #6
  call void @llvm.lifetime.start.p0(i64 1, ptr %5) #6
  call void @_ZNSaISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEEEC2Ev(ptr noundef nonnull align 1 dereferenceable(1) %5) #6
  invoke void @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EEC2EmRKS6_(ptr noundef nonnull align 8 dereferenceable(24) %4, i64 noundef 10, ptr noundef nonnull align 1 dereferenceable(1) %5)
          to label %50 unwind label %56

50:                                               ; preds = %1
  call void @_ZNSt15__new_allocatorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEEED2Ev(ptr noundef nonnull align 1 dereferenceable(1) %5) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr %5) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr %8) #6
  store i64 0, ptr %8, align 8, !tbaa !9
  br label %51

51:                                               ; preds = %79, %50
  %52 = load i64, ptr %8, align 8, !tbaa !9
  %53 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  %54 = icmp ult i64 %52, %53
  br i1 %54, label %60, label %55

55:                                               ; preds = %51
  call void @llvm.lifetime.end.p0(i64 8, ptr %8) #6
  br label %86

56:                                               ; preds = %1
  %57 = landingpad { ptr, i32 }
          cleanup
  %58 = extractvalue { ptr, i32 } %57, 0
  store ptr %58, ptr %6, align 8
  %59 = extractvalue { ptr, i32 } %57, 1
  store i32 %59, ptr %7, align 4
  call void @_ZNSt15__new_allocatorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEEED2Ev(ptr noundef nonnull align 1 dereferenceable(1) %5) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr %5) #6
  br label %281

60:                                               ; preds = %51
  %61 = load i64, ptr %8, align 8, !tbaa !9
  %62 = load i64, ptr %8, align 8, !tbaa !9
  %63 = invoke noundef nonnull align 8 dereferenceable(24) ptr @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE2atEm(ptr noundef nonnull align 8 dereferenceable(24) %4, i64 noundef %62)
          to label %64 unwind label %82

64:                                               ; preds = %60
  %65 = getelementptr inbounds %"struct.std::pair.334", ptr %63, i32 0, i32 0
  store i64 %61, ptr %65, align 8, !tbaa !11
  %66 = load i64, ptr %8, align 8, !tbaa !9
  %67 = invoke noundef nonnull align 8 dereferenceable(24) ptr @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE2atEm(ptr noundef nonnull align 8 dereferenceable(24) %4, i64 noundef %66)
          to label %68 unwind label %82

68:                                               ; preds = %64
  %69 = getelementptr inbounds %"struct.std::pair.334", ptr %67, i32 0, i32 1
  %70 = getelementptr inbounds %"struct.mjolnir::LennardJonesAttractivePotential<double>::parameter_type", ptr %69, i32 0, i32 1
  store double 1.000000e+00, ptr %70, align 8, !tbaa !15
  %71 = load i64, ptr %8, align 8, !tbaa !9
  %72 = uitofp i64 %71 to double
  %73 = fadd double %72, 1.000000e+00
  %74 = load i64, ptr %8, align 8, !tbaa !9
  %75 = invoke noundef nonnull align 8 dereferenceable(24) ptr @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE2atEm(ptr noundef nonnull align 8 dereferenceable(24) %4, i64 noundef %74)
          to label %76 unwind label %82

76:                                               ; preds = %68
  %77 = getelementptr inbounds %"struct.std::pair.334", ptr %75, i32 0, i32 1
  %78 = getelementptr inbounds %"struct.mjolnir::LennardJonesAttractivePotential<double>::parameter_type", ptr %77, i32 0, i32 0
  store double %73, ptr %78, align 8, !tbaa !16
  br label %79

79:                                               ; preds = %76
  %80 = load i64, ptr %8, align 8, !tbaa !9
  %81 = add i64 %80, 1
  store i64 %81, ptr %8, align 8, !tbaa !9
  br label %51, !llvm.loop !17

82:                                               ; preds = %68, %64, %60
  %83 = landingpad { ptr, i32 }
          cleanup
  %84 = extractvalue { ptr, i32 } %83, 0
  store ptr %84, ptr %6, align 8
  %85 = extractvalue { ptr, i32 } %83, 1
  store i32 %85, ptr %7, align 4
  call void @llvm.lifetime.end.p0(i64 8, ptr %8) #6
  br label %280

86:                                               ; preds = %55
  call void @llvm.lifetime.start.p0(i64 384, ptr %9) #6
  call void @llvm.lifetime.start.p0(i64 48, ptr %10) #6
  call void @llvm.memset.p0.i64(ptr align 8 %10, i8 0, i64 48, i1 false)
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessIS5_ESaISt4pairIKS5_mEEEC2Ev(ptr noundef nonnull align 8 dereferenceable(48) %10) #6
  call void @llvm.lifetime.start.p0(i64 32, ptr %12) #6
  call void @llvm.lifetime.start.p0(i64 1, ptr %13) #6
  call void @_ZNSaIcEC2Ev(ptr noundef nonnull align 1 dereferenceable(1) %13) #6
  invoke void @_ZNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEC2IS3_EEPKcRKS3_(ptr noundef nonnull align 8 dereferenceable(32) %12, ptr noundef @.str.409, ptr noundef nonnull align 1 dereferenceable(1) %13)
          to label %87 unwind label %107

87:                                               ; preds = %86
  invoke void @_ZN7mjolnir14IgnoreMoleculeImEC2ERKNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE(ptr noundef nonnull align 8 dereferenceable(8) %11, ptr noundef nonnull align 8 dereferenceable(32) %12)
          to label %88 unwind label %111

88:                                               ; preds = %87
  call void @llvm.lifetime.start.p0(i64 48, ptr %15) #6
  call void @llvm.memset.p0.i64(ptr align 8 %15, i8 0, i64 48, i1 false)
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEESt6vectorIS5_SaIS5_EESt4lessIS5_ESaISt4pairIKS5_S8_EEEC2Ev(ptr noundef nonnull align 8 dereferenceable(48) %15) #6
  invoke void @_ZN7mjolnir11IgnoreGroupINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEEC2ERKSt3mapIS6_St6vectorIS6_SaIS6_EESt4lessIS6_ESaISt4pairIKS6_SB_EEE(ptr noundef nonnull align 8 dereferenceable(72) %14, ptr noundef nonnull align 8 dereferenceable(48) %15)
          to label %89 unwind label %115

89:                                               ; preds = %88
  invoke void @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEEC2ERKSt6vectorISt4pairImNS5_14parameter_typeEESaISA_EERKSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessISL_ESaIS8_IKSL_mEEENS_14IgnoreMoleculeImEENS_11IgnoreGroupISL_EE(ptr noundef nonnull align 8 dereferenceable(384) %9, ptr noundef nonnull align 8 dereferenceable(24) %4, ptr noundef nonnull align 8 dereferenceable(48) %10, ptr noundef %11, ptr noundef %14)
          to label %90 unwind label %119

90:                                               ; preds = %89
  call void @_ZN7mjolnir11IgnoreGroupINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEED2Ev(ptr noundef nonnull align 8 dereferenceable(72) %14) #6
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEESt6vectorIS5_SaIS5_EESt4lessIS5_ESaISt4pairIKS5_S8_EEED2Ev(ptr noundef nonnull align 8 dereferenceable(48) %15) #6
  call void @llvm.lifetime.end.p0(i64 48, ptr %15) #6
  call void @_ZN7mjolnir14IgnoreMoleculeImED2Ev(ptr noundef nonnull align 8 dereferenceable(8) %11) #6
  call void @_ZNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEED2Ev(ptr noundef nonnull align 8 dereferenceable(32) %12) #6
  call void @_ZNSt15__new_allocatorIcED2Ev(ptr noundef nonnull align 1 dereferenceable(1) %13) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr %13) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr %12) #6
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessIS5_ESaISt4pairIKS5_mEEED2Ev(ptr noundef nonnull align 8 dereferenceable(48) %10) #6
  call void @llvm.lifetime.end.p0(i64 48, ptr %10) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr %16) #6
  %91 = call noundef nonnull align 8 dereferenceable(24) ptr @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEE10parametersEv(ptr noundef nonnull align 8 dereferenceable(384) %9) #6
  %92 = call ptr @_ZNSt6vectorIN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeESaIS3_EE5beginEv(ptr noundef nonnull align 8 dereferenceable(24) %91) #6
  %93 = getelementptr inbounds %"class.__gnu_cxx::__normal_iterator.363", ptr %17, i32 0, i32 0
  store ptr %92, ptr %93, align 8
  %94 = call noundef nonnull align 8 dereferenceable(24) ptr @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEE10parametersEv(ptr noundef nonnull align 8 dereferenceable(384) %9) #6
  %95 = call ptr @_ZNSt6vectorIN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeESaIS3_EE3endEv(ptr noundef nonnull align 8 dereferenceable(24) %94) #6
  %96 = getelementptr inbounds %"class.__gnu_cxx::__normal_iterator.363", ptr %18, i32 0, i32 0
  store ptr %95, ptr %96, align 8
  %97 = getelementptr inbounds %"class.__gnu_cxx::__normal_iterator.363", ptr %17, i32 0, i32 0
  %98 = load ptr, ptr %97, align 8
  %99 = getelementptr inbounds %"class.__gnu_cxx::__normal_iterator.363", ptr %18, i32 0, i32 0
  %100 = load ptr, ptr %99, align 8
  %101 = call noundef double @_ZNK7mjolnir31LennardJonesAttractivePotentialIdE10max_cutoffIN9__gnu_cxx17__normal_iteratorIPNS1_14parameter_typeESt6vectorIS5_SaIS5_EEEEEEdT_SB_(ptr noundef nonnull align 8 dereferenceable(16) %3, ptr %98, ptr %100) #6
  store double %101, ptr %16, align 8, !tbaa !19
  call void @llvm.lifetime.start.p0(i64 8, ptr %19) #6
  store double 0.000000e+00, ptr %19, align 8, !tbaa !19
  call void @llvm.lifetime.start.p0(i64 8, ptr %20) #6
  store i64 0, ptr %20, align 8, !tbaa !9
  br label %102

102:                                              ; preds = %152, %90
  %103 = load i64, ptr %20, align 8, !tbaa !9
  %104 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  %105 = icmp ult i64 %103, %104
  br i1 %105, label %126, label %106

106:                                              ; preds = %102
  store i32 5, ptr %21, align 4
  call void @llvm.lifetime.end.p0(i64 8, ptr %20) #6
  br label %155

107:                                              ; preds = %86
  %108 = landingpad { ptr, i32 }
          cleanup
  %109 = extractvalue { ptr, i32 } %108, 0
  store ptr %109, ptr %6, align 8
  %110 = extractvalue { ptr, i32 } %108, 1
  store i32 %110, ptr %7, align 4
  br label %125

111:                                              ; preds = %87
  %112 = landingpad { ptr, i32 }
          cleanup
  %113 = extractvalue { ptr, i32 } %112, 0
  store ptr %113, ptr %6, align 8
  %114 = extractvalue { ptr, i32 } %112, 1
  store i32 %114, ptr %7, align 4
  br label %124

115:                                              ; preds = %88
  %116 = landingpad { ptr, i32 }
          cleanup
  %117 = extractvalue { ptr, i32 } %116, 0
  store ptr %117, ptr %6, align 8
  %118 = extractvalue { ptr, i32 } %116, 1
  store i32 %118, ptr %7, align 4
  br label %123

119:                                              ; preds = %89
  %120 = landingpad { ptr, i32 }
          cleanup
  %121 = extractvalue { ptr, i32 } %120, 0
  store ptr %121, ptr %6, align 8
  %122 = extractvalue { ptr, i32 } %120, 1
  store i32 %122, ptr %7, align 4
  call void @_ZN7mjolnir11IgnoreGroupINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEED2Ev(ptr noundef nonnull align 8 dereferenceable(72) %14) #6
  br label %123

123:                                              ; preds = %119, %115
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEESt6vectorIS5_SaIS5_EESt4lessIS5_ESaISt4pairIKS5_S8_EEED2Ev(ptr noundef nonnull align 8 dereferenceable(48) %15) #6
  call void @llvm.lifetime.end.p0(i64 48, ptr %15) #6
  call void @_ZN7mjolnir14IgnoreMoleculeImED2Ev(ptr noundef nonnull align 8 dereferenceable(8) %11) #6
  br label %124

124:                                              ; preds = %123, %111
  call void @_ZNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEED2Ev(ptr noundef nonnull align 8 dereferenceable(32) %12) #6
  br label %125

125:                                              ; preds = %124, %107
  call void @_ZNSt15__new_allocatorIcED2Ev(ptr noundef nonnull align 1 dereferenceable(1) %13) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr %13) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr %12) #6
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessIS5_ESaISt4pairIKS5_mEEED2Ev(ptr noundef nonnull align 8 dereferenceable(48) %10) #6
  call void @llvm.lifetime.end.p0(i64 48, ptr %10) #6
  br label %279

126:                                              ; preds = %102
  call void @llvm.lifetime.start.p0(i64 8, ptr %22) #6
  store i64 0, ptr %22, align 8, !tbaa !9
  br label %127

127:                                              ; preds = %144, %126
  %128 = load i64, ptr %22, align 8, !tbaa !9
  %129 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  %130 = icmp ult i64 %128, %129
  br i1 %130, label %132, label %131

131:                                              ; preds = %127
  store i32 8, ptr %21, align 4
  call void @llvm.lifetime.end.p0(i64 8, ptr %22) #6
  br label %151

132:                                              ; preds = %127
  call void @llvm.lifetime.start.p0(i64 8, ptr %23) #6
  call void @llvm.lifetime.start.p0(i64 16, ptr %24) #6
  %133 = load i64, ptr %20, align 8, !tbaa !9
  %134 = load i64, ptr %22, align 8, !tbaa !9
  %135 = call { double, double } @_ZNK7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEE14prepare_paramsEmm(ptr noundef nonnull align 8 dereferenceable(384) %9, i64 noundef %133, i64 noundef %134) #6
  %136 = getelementptr inbounds { double, double }, ptr %24, i32 0, i32 0
  %137 = extractvalue { double, double } %135, 0
  store double %137, ptr %136, align 8
  %138 = getelementptr inbounds { double, double }, ptr %24, i32 0, i32 1
  %139 = extractvalue { double, double } %135, 1
  store double %139, ptr %138, align 8
  %140 = call noundef double @_ZNK7mjolnir31LennardJonesAttractivePotentialIdE15absolute_cutoffERKNS1_14parameter_typeE(ptr noundef nonnull align 8 dereferenceable(16) %3, ptr noundef nonnull align 8 dereferenceable(16) %24) #6
  store double %140, ptr %23, align 8, !tbaa !19
  %141 = invoke noundef nonnull align 8 dereferenceable(8) ptr @_ZSt3maxIdERKT_S2_S2_(ptr noundef nonnull align 8 dereferenceable(8) %19, ptr noundef nonnull align 8 dereferenceable(8) %23)
          to label %142 unwind label %147

142:                                              ; preds = %132
  %143 = load double, ptr %141, align 8, !tbaa !19
  store double %143, ptr %19, align 8, !tbaa !19
  call void @llvm.lifetime.end.p0(i64 16, ptr %24) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %23) #6
  br label %144

144:                                              ; preds = %142
  %145 = load i64, ptr %22, align 8, !tbaa !9
  %146 = add i64 %145, 1
  store i64 %146, ptr %22, align 8, !tbaa !9
  br label %127, !llvm.loop !20

147:                                              ; preds = %132
  %148 = landingpad { ptr, i32 }
          cleanup
  %149 = extractvalue { ptr, i32 } %148, 0
  store ptr %149, ptr %6, align 8
  %150 = extractvalue { ptr, i32 } %148, 1
  store i32 %150, ptr %7, align 4
  call void @llvm.lifetime.end.p0(i64 16, ptr %24) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %23) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %22) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %20) #6
  br label %278

151:                                              ; preds = %131
  br label %152

152:                                              ; preds = %151
  %153 = load i64, ptr %20, align 8, !tbaa !9
  %154 = add i64 %153, 1
  store i64 %154, ptr %20, align 8, !tbaa !9
  br label %102, !llvm.loop !21

155:                                              ; preds = %106
  br label %156

156:                                              ; preds = %173, %155
  %157 = load ptr, ptr @_ZN5boost9unit_test12_GLOBAL__N_113unit_test_logE, align 8, !tbaa !5
  invoke void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %25, ptr noundef @.str.401, i64 noundef 105)
          to label %158 unwind label %182

158:                                              ; preds = %156
  invoke void @_ZN5boost9unit_test13basic_cstringIKcEC2Ev(ptr noundef nonnull align 8 dereferenceable(16) %26)
          to label %159 unwind label %182

159:                                              ; preds = %158
  invoke void @_ZN5boost9unit_test15unit_test_log_t14set_checkpointENS0_13basic_cstringIKcEEmS4_(ptr noundef nonnull align 8 dereferenceable(8) %157, ptr noundef %25, i64 noundef 110, ptr noundef %26)
          to label %160 unwind label %182

160:                                              ; preds = %159
  call void @llvm.lifetime.start.p0(i64 24, ptr %27) #6
  call void @llvm.lifetime.start.p0(i64 16, ptr %28) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr %29) #6
  call void @llvm.lifetime.start.p0(i64 1, ptr %30) #6
  invoke void @_ZNK5boost10test_tools9assertion4seedpmIRdEENS1_10value_exprIT_EEOS6_(ptr dead_on_unwind writable sret(%"class.boost::test_tools::assertion::value_expr.366") align 8 %29, ptr noundef nonnull align 1 dereferenceable(1) %30, ptr noundef nonnull align 8 dereferenceable(8) %19)
          to label %161 unwind label %186

161:                                              ; preds = %160
  invoke void @_ZN5boost10test_tools9assertion15expression_baseINS1_10value_exprIRdEEdEleIRKdEENS1_11binary_exprIS5_T_NS1_2op2LEIdNS6_4RhsTISB_E4typeEvEEEEOSB_(ptr dead_on_unwind writable sret(%"class.boost::test_tools::assertion::binary_expr.364") align 8 %28, ptr noundef nonnull align 1 dereferenceable(1) %29, ptr noundef nonnull align 8 dereferenceable(8) %16)
          to label %162 unwind label %186

162:                                              ; preds = %161
  invoke void @_ZNK5boost10test_tools9assertion11binary_exprINS1_10value_exprIRdEERKdNS1_2op2LEIddvEEE8evaluateEb(ptr dead_on_unwind writable sret(%"class.boost::test_tools::assertion_result") align 8 %27, ptr noundef nonnull align 8 dereferenceable(16) %28, i1 noundef zeroext false)
          to label %163 unwind label %186

163:                                              ; preds = %162
  call void @llvm.lifetime.start.p0(i64 32, ptr %31) #6
  %164 = invoke noundef nonnull align 8 dereferenceable(9) ptr @_ZN5boost9unit_test12lazy_ostream8instanceEv()
          to label %165 unwind label %190

165:                                              ; preds = %163
  call void @llvm.lifetime.start.p0(i64 16, ptr %32) #6
  invoke void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %32, ptr noundef @.str.410, i64 noundef 28)
          to label %166 unwind label %194

166:                                              ; preds = %165
  invoke void @_ZN5boost9unit_testlsINS0_13basic_cstringIKcEEEENS0_17lazy_ostream_implINS0_12lazy_ostreamET_RKS7_EERKS6_S9_(ptr dead_on_unwind writable sret(%"class.boost::unit_test::lazy_ostream_impl.320") align 8 %31, ptr noundef nonnull align 8 dereferenceable(9) %164, ptr noundef nonnull align 8 dereferenceable(16) %32)
          to label %167 unwind label %194

167:                                              ; preds = %166
  invoke void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %33, ptr noundef @.str.401, i64 noundef 105)
          to label %168 unwind label %198

168:                                              ; preds = %167
  %169 = invoke noundef zeroext i1 (ptr, ptr, ptr, i64, i32, i32, i64, ...) @_ZN5boost10test_tools9tt_detail16report_assertionERKNS0_16assertion_resultERKNS_9unit_test12lazy_ostreamENS5_13basic_cstringIKcEEmNS1_10tool_levelENS1_10check_typeEmz(ptr noundef nonnull align 8 dereferenceable(24) %27, ptr noundef nonnull align 8 dereferenceable(9) %31, ptr noundef %33, i64 noundef 110, i32 noundef 1, i32 noundef 14, i64 noundef 0)
          to label %170 unwind label %198

170:                                              ; preds = %168
  call void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(32) %31) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %32) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr %31) #6
  call void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24) %27) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr %30) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %29) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %28) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr %27) #6
  br label %171

171:                                              ; preds = %170
  %172 = invoke noundef zeroext i1 @_ZN5boost10test_tools9tt_detail10dummy_condEv()
          to label %173 unwind label %182

173:                                              ; preds = %171
  br i1 %172, label %156, label %174, !llvm.loop !22

174:                                              ; preds = %173
  call void @llvm.lifetime.start.p0(i64 8, ptr %34) #6
  %175 = call noundef double @_ZNSt14numeric_limitsIdE7epsilonEv() #6
  %176 = fadd double 1.000000e+00, %175
  store double %176, ptr %34, align 8, !tbaa !19
  call void @llvm.lifetime.start.p0(i64 8, ptr %35) #6
  store i64 0, ptr %35, align 8, !tbaa !9
  br label %177

177:                                              ; preds = %274, %174
  %178 = load i64, ptr %35, align 8, !tbaa !9
  %179 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  %180 = icmp ult i64 %178, %179
  br i1 %180, label %205, label %181

181:                                              ; preds = %177
  store i32 13, ptr %21, align 4
  call void @llvm.lifetime.end.p0(i64 8, ptr %35) #6
  br label %277

182:                                              ; preds = %171, %159, %158, %156
  %183 = landingpad { ptr, i32 }
          cleanup
  %184 = extractvalue { ptr, i32 } %183, 0
  store ptr %184, ptr %6, align 8
  %185 = extractvalue { ptr, i32 } %183, 1
  store i32 %185, ptr %7, align 4
  br label %278

186:                                              ; preds = %162, %161, %160
  %187 = landingpad { ptr, i32 }
          cleanup
  %188 = extractvalue { ptr, i32 } %187, 0
  store ptr %188, ptr %6, align 8
  %189 = extractvalue { ptr, i32 } %187, 1
  store i32 %189, ptr %7, align 4
  br label %204

190:                                              ; preds = %163
  %191 = landingpad { ptr, i32 }
          cleanup
  %192 = extractvalue { ptr, i32 } %191, 0
  store ptr %192, ptr %6, align 8
  %193 = extractvalue { ptr, i32 } %191, 1
  store i32 %193, ptr %7, align 4
  br label %203

194:                                              ; preds = %166, %165
  %195 = landingpad { ptr, i32 }
          cleanup
  %196 = extractvalue { ptr, i32 } %195, 0
  store ptr %196, ptr %6, align 8
  %197 = extractvalue { ptr, i32 } %195, 1
  store i32 %197, ptr %7, align 4
  br label %202

198:                                              ; preds = %168, %167
  %199 = landingpad { ptr, i32 }
          cleanup
  %200 = extractvalue { ptr, i32 } %199, 0
  store ptr %200, ptr %6, align 8
  %201 = extractvalue { ptr, i32 } %199, 1
  store i32 %201, ptr %7, align 4
  call void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(32) %31) #6
  br label %202

202:                                              ; preds = %198, %194
  call void @llvm.lifetime.end.p0(i64 16, ptr %32) #6
  br label %203

203:                                              ; preds = %202, %190
  call void @llvm.lifetime.end.p0(i64 32, ptr %31) #6
  call void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24) %27) #6
  br label %204

204:                                              ; preds = %203, %186
  call void @llvm.lifetime.end.p0(i64 1, ptr %30) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %29) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %28) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr %27) #6
  br label %278

205:                                              ; preds = %177
  call void @llvm.lifetime.start.p0(i64 8, ptr %36) #6
  store i64 0, ptr %36, align 8, !tbaa !9
  br label %206

206:                                              ; preds = %241, %205
  %207 = load i64, ptr %36, align 8, !tbaa !9
  %208 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  %209 = icmp ult i64 %207, %208
  br i1 %209, label %211, label %210

210:                                              ; preds = %206
  store i32 16, ptr %21, align 4
  call void @llvm.lifetime.end.p0(i64 8, ptr %36) #6
  br label %273

211:                                              ; preds = %206
  br label %212

212:                                              ; preds = %239, %211
  %213 = load ptr, ptr @_ZN5boost9unit_test12_GLOBAL__N_113unit_test_logE, align 8, !tbaa !5
  invoke void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %37, ptr noundef @.str.401, i64 noundef 105)
          to label %214 unwind label %244

214:                                              ; preds = %212
  invoke void @_ZN5boost9unit_test13basic_cstringIKcEC2Ev(ptr noundef nonnull align 8 dereferenceable(16) %38)
          to label %215 unwind label %244

215:                                              ; preds = %214
  invoke void @_ZN5boost9unit_test15unit_test_log_t14set_checkpointENS0_13basic_cstringIKcEEmS4_(ptr noundef nonnull align 8 dereferenceable(8) %213, ptr noundef %37, i64 noundef 117, ptr noundef %38)
          to label %216 unwind label %244

216:                                              ; preds = %215
  call void @llvm.lifetime.start.p0(i64 24, ptr %39) #6
  call void @llvm.lifetime.start.p0(i64 16, ptr %40) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr %41) #6
  call void @llvm.lifetime.start.p0(i64 1, ptr %42) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr %43) #6
  %217 = load double, ptr %19, align 8, !tbaa !19
  %218 = fmul double %217, 0x3FF0000000000001
  call void @llvm.lifetime.start.p0(i64 16, ptr %44) #6
  %219 = load i64, ptr %35, align 8, !tbaa !9
  %220 = load i64, ptr %36, align 8, !tbaa !9
  %221 = call { double, double } @_ZNK7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEE14prepare_paramsEmm(ptr noundef nonnull align 8 dereferenceable(384) %9, i64 noundef %219, i64 noundef %220) #6
  %222 = getelementptr inbounds { double, double }, ptr %44, i32 0, i32 0
  %223 = extractvalue { double, double } %221, 0
  store double %223, ptr %222, align 8
  %224 = getelementptr inbounds { double, double }, ptr %44, i32 0, i32 1
  %225 = extractvalue { double, double } %221, 1
  store double %225, ptr %224, align 8
  %226 = call noundef double @_ZNK7mjolnir31LennardJonesAttractivePotentialIdE9potentialEdRKNS1_14parameter_typeE(ptr noundef nonnull align 8 dereferenceable(16) %3, double noundef %218, ptr noundef nonnull align 8 dereferenceable(16) %44) #6
  store double %226, ptr %43, align 8, !tbaa !19
  invoke void @_ZNK5boost10test_tools9assertion4seedpmIdEENS1_10value_exprIT_EEOS5_(ptr dead_on_unwind writable sret(%"class.boost::test_tools::assertion::value_expr") align 8 %41, ptr noundef nonnull align 1 dereferenceable(1) %42, ptr noundef nonnull align 8 dereferenceable(8) %43)
          to label %227 unwind label %248

227:                                              ; preds = %216
  call void @llvm.lifetime.start.p0(i64 8, ptr %45) #6
  store double 0.000000e+00, ptr %45, align 8, !tbaa !19
  invoke void @_ZN5boost10test_tools9assertion15expression_baseINS1_10value_exprIdEEdEeqIdEENS1_11binary_exprIS4_T_NS1_2op2EQIdNS5_4RhsTIS8_E4typeEvEEEEOS8_(ptr dead_on_unwind writable sret(%"class.boost::test_tools::assertion::binary_expr") align 8 %40, ptr noundef nonnull align 1 dereferenceable(1) %41, ptr noundef nonnull align 8 dereferenceable(8) %45)
          to label %228 unwind label %252

228:                                              ; preds = %227
  invoke void @_ZNK5boost10test_tools9assertion11binary_exprINS1_10value_exprIdEEdNS1_2op2EQIddvEEE8evaluateEb(ptr dead_on_unwind writable sret(%"class.boost::test_tools::assertion_result") align 8 %39, ptr noundef nonnull align 8 dereferenceable(16) %40, i1 noundef zeroext false)
          to label %229 unwind label %252

229:                                              ; preds = %228
  call void @llvm.lifetime.start.p0(i64 32, ptr %46) #6
  %230 = invoke noundef nonnull align 8 dereferenceable(9) ptr @_ZN5boost9unit_test12lazy_ostream8instanceEv()
          to label %231 unwind label %256

231:                                              ; preds = %229
  call void @llvm.lifetime.start.p0(i64 16, ptr %47) #6
  invoke void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %47, ptr noundef @.str.411, i64 noundef 88)
          to label %232 unwind label %260

232:                                              ; preds = %231
  invoke void @_ZN5boost9unit_testlsINS0_13basic_cstringIKcEEEENS0_17lazy_ostream_implINS0_12lazy_ostreamET_RKS7_EERKS6_S9_(ptr dead_on_unwind writable sret(%"class.boost::unit_test::lazy_ostream_impl.320") align 8 %46, ptr noundef nonnull align 8 dereferenceable(9) %230, ptr noundef nonnull align 8 dereferenceable(16) %47)
          to label %233 unwind label %260

233:                                              ; preds = %232
  invoke void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %48, ptr noundef @.str.401, i64 noundef 105)
          to label %234 unwind label %264

234:                                              ; preds = %233
  %235 = invoke noundef zeroext i1 (ptr, ptr, ptr, i64, i32, i32, i64, ...) @_ZN5boost10test_tools9tt_detail16report_assertionERKNS0_16assertion_resultERKNS_9unit_test12lazy_ostreamENS5_13basic_cstringIKcEEmNS1_10tool_levelENS1_10check_typeEmz(ptr noundef nonnull align 8 dereferenceable(24) %39, ptr noundef nonnull align 8 dereferenceable(9) %46, ptr noundef %48, i64 noundef 117, i32 noundef 1, i32 noundef 14, i64 noundef 0)
          to label %236 unwind label %264

236:                                              ; preds = %234
  call void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(32) %46) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %47) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr %46) #6
  call void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24) %39) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %45) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %44) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %43) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr %42) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %41) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %40) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr %39) #6
  br label %237

237:                                              ; preds = %236
  %238 = invoke noundef zeroext i1 @_ZN5boost10test_tools9tt_detail10dummy_condEv()
          to label %239 unwind label %244

239:                                              ; preds = %237
  br i1 %238, label %212, label %240, !llvm.loop !23

240:                                              ; preds = %239
  br label %241

241:                                              ; preds = %240
  %242 = load i64, ptr %36, align 8, !tbaa !9
  %243 = add i64 %242, 1
  store i64 %243, ptr %36, align 8, !tbaa !9
  br label %206, !llvm.loop !24

244:                                              ; preds = %237, %215, %214, %212
  %245 = landingpad { ptr, i32 }
          cleanup
  %246 = extractvalue { ptr, i32 } %245, 0
  store ptr %246, ptr %6, align 8
  %247 = extractvalue { ptr, i32 } %245, 1
  store i32 %247, ptr %7, align 4
  br label %272

248:                                              ; preds = %216
  %249 = landingpad { ptr, i32 }
          cleanup
  %250 = extractvalue { ptr, i32 } %249, 0
  store ptr %250, ptr %6, align 8
  %251 = extractvalue { ptr, i32 } %249, 1
  store i32 %251, ptr %7, align 4
  br label %271

252:                                              ; preds = %228, %227
  %253 = landingpad { ptr, i32 }
          cleanup
  %254 = extractvalue { ptr, i32 } %253, 0
  store ptr %254, ptr %6, align 8
  %255 = extractvalue { ptr, i32 } %253, 1
  store i32 %255, ptr %7, align 4
  br label %270

256:                                              ; preds = %229
  %257 = landingpad { ptr, i32 }
          cleanup
  %258 = extractvalue { ptr, i32 } %257, 0
  store ptr %258, ptr %6, align 8
  %259 = extractvalue { ptr, i32 } %257, 1
  store i32 %259, ptr %7, align 4
  br label %269

260:                                              ; preds = %232, %231
  %261 = landingpad { ptr, i32 }
          cleanup
  %262 = extractvalue { ptr, i32 } %261, 0
  store ptr %262, ptr %6, align 8
  %263 = extractvalue { ptr, i32 } %261, 1
  store i32 %263, ptr %7, align 4
  br label %268

264:                                              ; preds = %234, %233
  %265 = landingpad { ptr, i32 }
          cleanup
  %266 = extractvalue { ptr, i32 } %265, 0
  store ptr %266, ptr %6, align 8
  %267 = extractvalue { ptr, i32 } %265, 1
  store i32 %267, ptr %7, align 4
  call void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(32) %46) #6
  br label %268

268:                                              ; preds = %264, %260
  call void @llvm.lifetime.end.p0(i64 16, ptr %47) #6
  br label %269

269:                                              ; preds = %268, %256
  call void @llvm.lifetime.end.p0(i64 32, ptr %46) #6
  call void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24) %39) #6
  br label %270

270:                                              ; preds = %269, %252
  call void @llvm.lifetime.end.p0(i64 8, ptr %45) #6
  br label %271

271:                                              ; preds = %270, %248
  call void @llvm.lifetime.end.p0(i64 16, ptr %44) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %43) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr %42) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %41) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %40) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr %39) #6
  br label %272

272:                                              ; preds = %271, %244
  call void @llvm.lifetime.end.p0(i64 8, ptr %36) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %35) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %34) #6
  br label %278

273:                                              ; preds = %210
  br label %274

274:                                              ; preds = %273
  %275 = load i64, ptr %35, align 8, !tbaa !9
  %276 = add i64 %275, 1
  store i64 %276, ptr %35, align 8, !tbaa !9
  br label %177, !llvm.loop !25

277:                                              ; preds = %181
  call void @llvm.lifetime.end.p0(i64 8, ptr %34) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %19) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %16) #6
  call void @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEED2Ev(ptr noundef nonnull align 8 dereferenceable(384) %9) #6
  call void @llvm.lifetime.end.p0(i64 384, ptr %9) #6
  call void @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EED2Ev(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr %4) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %3) #6
  ret void

278:                                              ; preds = %272, %204, %182, %147
  call void @llvm.lifetime.end.p0(i64 8, ptr %19) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %16) #6
  call void @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEED2Ev(ptr noundef nonnull align 8 dereferenceable(384) %9) #6
  br label %279

279:                                              ; preds = %278, %125
  call void @llvm.lifetime.end.p0(i64 384, ptr %9) #6
  br label %280

280:                                              ; preds = %279, %82
  call void @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EED2Ev(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  br label %281

281:                                              ; preds = %280, %56
  call void @llvm.lifetime.end.p0(i64 24, ptr %4) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %3) #6
  br label %282

282:                                              ; preds = %281
  %283 = load ptr, ptr %6, align 8
  %284 = load i32, ptr %7, align 4
  %285 = insertvalue { ptr, i32 } poison, ptr %283, 0
  %286 = insertvalue { ptr, i32 } %285, i32 %284, 1
  resume { ptr, i32 } %286
}

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSaISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEEEC2Ev(ptr noundef nonnull align 1 dereferenceable(1)) unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EEC2EmRKS6_(ptr noundef nonnull align 8 dereferenceable(24), i64 noundef, ptr noundef nonnull align 1 dereferenceable(1)) unnamed_addr #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24)) #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local noundef nonnull align 8 dereferenceable(24) ptr @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE2atEm(ptr noundef nonnull align 8 dereferenceable(24), i64 noundef) #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessIS5_ESaISt4pairIKS5_mEEEC2Ev(ptr noundef nonnull align 8 dereferenceable(48)) unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZN7mjolnir14IgnoreMoleculeImEC2ERKNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE(ptr noundef nonnull align 8 dereferenceable(8), ptr noundef nonnull align 8 dereferenceable(32)) unnamed_addr #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEESt6vectorIS5_SaIS5_EESt4lessIS5_ESaISt4pairIKS5_S8_EEEC2Ev(ptr noundef nonnull align 8 dereferenceable(48)) unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZN7mjolnir11IgnoreGroupINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEEC2ERKSt3mapIS6_St6vectorIS6_SaIS6_EESt4lessIS6_ESaISt4pairIKS6_SB_EEE(ptr noundef nonnull align 8 dereferenceable(72), ptr noundef nonnull align 8 dereferenceable(48)) unnamed_addr #2 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEEC2ERKSt6vectorISt4pairImNS5_14parameter_typeEESaISA_EERKSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessISL_ESaIS8_IKSL_mEEENS_14IgnoreMoleculeImEENS_11IgnoreGroupISL_EE(ptr noundef nonnull align 8 dereferenceable(384), ptr noundef nonnull align 8 dereferenceable(24), ptr noundef nonnull align 8 dereferenceable(48), ptr noundef, ptr noundef) unnamed_addr #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZN7mjolnir11IgnoreGroupINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEED2Ev(ptr noundef nonnull align 8 dereferenceable(72)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEESt6vectorIS5_SaIS5_EESt4lessIS5_ESaISt4pairIKS5_S8_EEED2Ev(ptr noundef nonnull align 8 dereferenceable(48)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZN7mjolnir14IgnoreMoleculeImED2Ev(ptr noundef nonnull align 8 dereferenceable(8)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessIS5_ESaISt4pairIKS5_mEEED2Ev(ptr noundef nonnull align 8 dereferenceable(48)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local noundef double @_ZNK7mjolnir31LennardJonesAttractivePotentialIdE10max_cutoffIN9__gnu_cxx17__normal_iteratorIPNS1_14parameter_typeESt6vectorIS5_SaIS5_EEEEEEdT_SB_(ptr noundef nonnull align 8 dereferenceable(16), ptr, ptr) #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local noundef nonnull align 8 dereferenceable(24) ptr @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEE10parametersEv(ptr noundef nonnull align 8 dereferenceable(384)) #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local ptr @_ZNSt6vectorIN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeESaIS3_EE5beginEv(ptr noundef nonnull align 8 dereferenceable(24)) #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local ptr @_ZNSt6vectorIN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeESaIS3_EE3endEv(ptr noundef nonnull align 8 dereferenceable(24)) #1 align 2

; Function Attrs: inlinehint mustprogress nounwind uwtable
declare dso_local noundef nonnull align 8 dereferenceable(8) ptr @_ZSt3maxIdERKT_S2_S2_(ptr noundef nonnull align 8 dereferenceable(8), ptr noundef nonnull align 8 dereferenceable(8)) #4

; Function Attrs: mustprogress nounwind uwtable
declare dso_local noundef double @_ZNK7mjolnir31LennardJonesAttractivePotentialIdE15absolute_cutoffERKNS1_14parameter_typeE(ptr noundef nonnull align 8 dereferenceable(16), ptr noundef nonnull align 8 dereferenceable(16)) #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local { double, double } @_ZNK7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEE14prepare_paramsEmm(ptr noundef nonnull align 8 dereferenceable(384), i64 noundef, i64 noundef) unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZNK5boost10test_tools9assertion4seedpmIRdEENS1_10value_exprIT_EEOS6_(ptr dead_on_unwind noalias writable sret(%"class.boost::test_tools::assertion::value_expr.366") align 8, ptr noundef nonnull align 1 dereferenceable(1), ptr noundef nonnull align 8 dereferenceable(8)) #2 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZN5boost10test_tools9assertion15expression_baseINS1_10value_exprIRdEEdEleIRKdEENS1_11binary_exprIS5_T_NS1_2op2LEIdNS6_4RhsTISB_E4typeEvEEEEOSB_(ptr dead_on_unwind noalias writable sret(%"class.boost::test_tools::assertion::binary_expr.364") align 8, ptr noundef nonnull align 1 dereferenceable(1), ptr noundef nonnull align 8 dereferenceable(8)) #2 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZNK5boost10test_tools9assertion11binary_exprINS1_10value_exprIRdEERKdNS1_2op2LEIddvEEE8evaluateEb(ptr dead_on_unwind noalias writable sret(%"class.boost::test_tools::assertion_result") align 8, ptr noundef nonnull align 8 dereferenceable(16), i1 noundef zeroext) #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local noundef double @_ZNSt14numeric_limitsIdE7epsilonEv() #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZNK5boost10test_tools9assertion11binary_exprINS1_10value_exprIdEEdNS1_2op2EQIddvEEE8evaluateEb(ptr dead_on_unwind noalias writable sret(%"class.boost::test_tools::assertion_result") align 8, ptr noundef nonnull align 8 dereferenceable(16), i1 noundef zeroext) #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEED2Ev(ptr noundef nonnull align 8 dereferenceable(384)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EED2Ev(ptr noundef nonnull align 8 dereferenceable(24)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSt15__new_allocatorIcED2Ev(ptr noundef nonnull align 1 dereferenceable(1)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(9)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSt15__new_allocatorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEEED2Ev(ptr noundef nonnull align 1 dereferenceable(1)) unnamed_addr #1 align 2

attributes #0 = { nocallback nofree nosync nounwind willreturn memory(argmem: readwrite) }
attributes #1 = { mustprogress nounwind uwtable "min-legal-vector-width"="0" "no-trapping-math"="true" "stack-protector-buffer-size"="8" "target-cpu"="x86-64" "target-features"="+cmov,+cx8,+fxsr,+mmx,+sse,+sse2,+x87" "tune-cpu"="generic" }
attributes #2 = { mustprogress uwtable "min-legal-vector-width"="0" "no-trapping-math"="true" "stack-protector-buffer-size"="8" "target-cpu"="x86-64" "target-features"="+cmov,+cx8,+fxsr,+mmx,+sse,+sse2,+x87" "tune-cpu"="generic" }
attributes #3 = { nocallback nofree nounwind willreturn memory(argmem: write) }
attributes #4 = { inlinehint mustprogress nounwind uwtable "min-legal-vector-width"="0" "no-trapping-math"="true" "stack-protector-buffer-size"="8" "target-cpu"="x86-64" "target-features"="+cmov,+cx8,+fxsr,+mmx,+sse,+sse2,+x87" "tune-cpu"="generic" }
attributes #5 = { inlinehint mustprogress uwtable "min-legal-vector-width"="0" "no-trapping-math"="true" "stack-protector-buffer-size"="8" "target-cpu"="x86-64" "target-features"="+cmov,+cx8,+fxsr,+mmx,+sse,+sse2,+x87" "tune-cpu"="generic" }
attributes #6 = { nounwind }

!llvm.module.flags = !{!0, !1, !2, !3}
!llvm.ident = !{!4}

!0 = !{i32 1, !"wchar_size", i32 4}
!1 = !{i32 8, !"PIC Level", i32 2}
!2 = !{i32 7, !"PIE Level", i32 2}
!3 = !{i32 7, !"uwtable", i32 2}
!4 = !{!"clang version 19.1.0 (git@github.com:llvm/llvm-project.git a4bf6cd7cfb1a1421ba92bca9d017b49936c55e4)"}
!5 = !{!6, !6, i64 0}
!6 = !{!"any pointer", !7, i64 0}
!7 = !{!"omnipotent char", !8, i64 0}
!8 = !{!"Simple C++ TBAA"}
!9 = !{!10, !10, i64 0}
!10 = !{!"long", !7, i64 0}
!11 = !{!12, !10, i64 0}
!12 = !{!"_ZTSSt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEE", !10, i64 0, !13, i64 8}
!13 = !{!"_ZTSN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeE", !14, i64 0, !14, i64 8}
!14 = !{!"double", !7, i64 0}
!15 = !{!12, !14, i64 16}
!16 = !{!12, !14, i64 8}
!17 = distinct !{!17, !18}
!18 = !{!"llvm.loop.mustprogress"}
!19 = !{!14, !14, i64 0}
!20 = distinct !{!20, !18}
!21 = distinct !{!21, !18}
!22 = distinct !{!22, !18}
!23 = distinct !{!23, !18}
!24 = distinct !{!24, !18}
!25 = distinct !{!25, !18}


; Optimized IR (opt -passes='default<O3>'):
target datalayout = "e-m:e-p270:32:32-p271:32:32-p272:64:64-i64:64-i128:128-f80:128-n8:16:32:64-S128"
target triple = "x86_64-unknown-linux-gnu"

%"class.boost::test_tools::assertion::value_expr" = type { double }
%"class.boost::test_tools::assertion::binary_expr" = type { %"class.boost::test_tools::assertion::value_expr", double }
%"class.boost::unit_test::lazy_ostream_impl.320" = type { %"class.boost::unit_test::lazy_ostream.base", ptr, ptr }
%"class.boost::unit_test::lazy_ostream.base" = type <{ ptr, i8 }>
%"class.mjolnir::LennardJonesAttractivePotential" = type { double, double }
%"class.std::vector.329" = type { %"struct.std::_Vector_base.330" }
%"struct.std::_Vector_base.330" = type { %"struct.std::_Vector_base<std::pair<unsigned long, mjolnir::LennardJonesAttractivePotential<double>::parameter_type>, std::allocator<std::pair<unsigned long, mjolnir::LennardJonesAttractivePotential<double>::parameter_type>>>::_Vector_impl" }
%"struct.std::_Vector_base<std::pair<unsigned long, mjolnir::LennardJonesAttractivePotential<double>::parameter_type>, std::allocator<std::pair<unsigned long, mjolnir::LennardJonesAttractivePotential<double>::parameter_type>>>::_Vector_impl" = type { %"struct.std::_Vector_base<std::pair<unsigned long, mjolnir::LennardJonesAttractivePotential<double>::parameter_type>, std::allocator<std::pair<unsigned long, mjolnir::LennardJonesAttractivePotential<double>::parameter_type>>>::_Vector_impl_data" }
%"struct.std::_Vector_base<std::pair<unsigned long, mjolnir::LennardJonesAttractivePotential<double>::parameter_type>, std::allocator<std::pair<unsigned long, mjolnir::LennardJonesAttractivePotential<double>::parameter_type>>>::_Vector_impl_data" = type { ptr, ptr, ptr }
%"class.std::allocator.331" = type { i8 }
%"class.mjolnir::LorentzBerthelotRule" = type { %"struct.mjolnir::ParameterListBase", double, %"class.std::vector.7", %"class.std::vector.336", %"class.mjolnir::ExclusionList" }
%"struct.mjolnir::ParameterListBase" = type { ptr }
%"class.std::vector.7" = type { %"struct.std::_Vector_base.8" }
%"struct.std::_Vector_base.8" = type { %"struct.std::_Vector_base<unsigned long, std::allocator<unsigned long>>::_Vector_impl" }
%"struct.std::_Vector_base<unsigned long, std::allocator<unsigned long>>::_Vector_impl" = type { %"struct.std::_Vector_base<unsigned long, std::allocator<unsigned long>>::_Vector_impl_data" }
%"struct.std::_Vector_base<unsigned long, std::allocator<unsigned long>>::_Vector_impl_data" = type { ptr, ptr, ptr }
%"class.std::vector.336" = type { %"struct.std::_Vector_base.337" }
%"struct.std::_Vector_base.337" = type { %"struct.std::_Vector_base<mjolnir::LennardJonesAttractivePotential<double>::parameter_type, std::allocator<mjolnir::LennardJonesAttractivePotential<double>::parameter_type>>::_Vector_impl" }
%"struct.std::_Vector_base<mjolnir::LennardJonesAttractivePotential<double>::parameter_type, std::allocator<mjolnir::LennardJonesAttractivePotential<double>::parameter_type>>::_Vector_impl" = type { %"struct.std::_Vector_base<mjolnir::LennardJonesAttractivePotential<double>::parameter_type, std::allocator<mjolnir::LennardJonesAttractivePotential<double>::parameter_type>>::_Vector_impl_data" }
%"struct.std::_Vector_base<mjolnir::LennardJonesAttractivePotential<double>::parameter_type, std::allocator<mjolnir::LennardJonesAttractivePotential<double>::parameter_type>>::_Vector_impl_data" = type { ptr, ptr, ptr }
%"class.mjolnir::ExclusionList" = type { %"class.mjolnir::IgnoreMolecule", %"class.mjolnir::IgnoreGroup", %"class.std::vector.348", %"class.std::vector.7", %"class.std::vector", %"class.std::vector.7", %"class.std::vector.7", %"class.std::vector.353", %"class.std::vector.7", %"class.std::vector.353", %"class.std::vector.7", %"class.std::vector.353" }
%"class.mjolnir::IgnoreMolecule" = type { %"class.std::unique_ptr" }
%"class.std::unique_ptr" = type { %"struct.std::__uniq_ptr_data" }
%"struct.std::__uniq_ptr_data" = type { %"class.std::__uniq_ptr_impl" }
%"class.std::__uniq_ptr_impl" = type { %"class.std::tuple" }
%"class.std::tuple" = type { %"struct.std::_Tuple_impl" }
%"struct.std::_Tuple_impl" = type { %"struct.std::_Head_base.342" }
%"struct.std::_Head_base.342" = type { ptr }
%"class.mjolnir::IgnoreGroup" = type { %"class.std::map.343", %"class.std::vector" }
%"class.std::map.343" = type { %"class.std::_Rb_tree.344" }
%"class.std::_Rb_tree.344" = type { %"struct.std::_Rb_tree<std::__cxx11::basic_string<char>, std::pair<const std::__cxx11::basic_string<char>, std::vector<std::__cxx11::basic_string<char>>>, std::_Select1st<std::pair<const std::__cxx11::basic_string<char>, std::vector<std::__cxx11::basic_string<char>>>>, std::less<std::__cxx11::basic_string<char>>>::_Rb_tree_impl" }
%"struct.std::_Rb_tree<std::__cxx11::basic_string<char>, std::pair<const std::__cxx11::basic_string<char>, std::vector<std::__cxx11::basic_string<char>>>, std::_Select1st<std::pair<const std::__cxx11::basic_string<char>, std::vector<std::__cxx11::basic_string<char>>>>, std::less<std::__cxx11::basic_string<char>>>::_Rb_tree_impl" = type { [8 x i8], %"struct.std::_Rb_tree_header" }
%"struct.std::_Rb_tree_header" = type { %"struct.std::_Rb_tree_node_base", i64 }
%"struct.std::_Rb_tree_node_base" = type { i32, ptr, ptr, ptr }
%"class.std::vector.348" = type { %"struct.std::_Vector_base.349" }
%"struct.std::_Vector_base.349" = type { %"struct.std::_Vector_base<std::pair<std::__cxx11::basic_string<char>, unsigned long>, std::allocator<std::pair<std::__cxx11::basic_string<char>, unsigned long>>>::_Vector_impl" }
%"struct.std::_Vector_base<std::pair<std::__cxx11::basic_string<char>, unsigned long>, std::allocator<std::pair<std::__cxx11::basic_string<char>, unsigned long>>>::_Vector_impl" = type { %"struct.std::_Vector_base<std::pair<std::__cxx11::basic_string<char>, unsigned long>, std::allocator<std::pair<std::__cxx11::basic_string<char>, unsigned long>>>::_Vector_impl_data" }
%"struct.std::_Vector_base<std::pair<std::__cxx11::basic_string<char>, unsigned long>, std::allocator<std::pair<std::__cxx11::basic_string<char>, unsigned long>>>::_Vector_impl_data" = type { ptr, ptr, ptr }
%"class.std::vector" = type { %"struct.std::_Vector_base" }
%"struct.std::_Vector_base" = type { %"struct.std::_Vector_base<std::__cxx11::basic_string<char>, std::allocator<std::__cxx11::basic_string<char>>>::_Vector_impl" }
%"struct.std::_Vector_base<std::__cxx11::basic_string<char>, std::allocator<std::__cxx11::basic_string<char>>>::_Vector_impl" = type { %"struct.std::_Vector_base<std::__cxx11::basic_string<char>, std::allocator<std::__cxx11::basic_string<char>>>::_Vector_impl_data" }
%"struct.std::_Vector_base<std::__cxx11::basic_string<char>, std::allocator<std::__cxx11::basic_string<char>>>::_Vector_impl_data" = type { ptr, ptr, ptr }
%"class.std::vector.353" = type { %"struct.std::_Vector_base.354" }
%"struct.std::_Vector_base.354" = type { %"struct.std::_Vector_base<std::pair<unsigned long, unsigned long>, std::allocator<std::pair<unsigned long, unsigned long>>>::_Vector_impl" }
%"struct.std::_Vector_base<std::pair<unsigned long, unsigned long>, std::allocator<std::pair<unsigned long, unsigned long>>>::_Vector_impl" = type { %"struct.std::_Vector_base<std::pair<unsigned long, unsigned long>, std::allocator<std::pair<unsigned long, unsigned long>>>::_Vector_impl_data" }
%"struct.std::_Vector_base<std::pair<unsigned long, unsigned long>, std::allocator<std::pair<unsigned long, unsigned long>>>::_Vector_impl_data" = type { ptr, ptr, ptr }
%"class.std::map.358" = type { %"class.std::_Rb_tree.359" }
%"class.std::_Rb_tree.359" = type { %"struct.std::_Rb_tree<std::__cxx11::basic_string<char>, std::pair<const std::__cxx11::basic_string<char>, unsigned long>, std::_Select1st<std::pair<const std::__cxx11::basic_string<char>, unsigned long>>, std::less<std::__cxx11::basic_string<char>>>::_Rb_tree_impl" }
%"struct.std::_Rb_tree<std::__cxx11::basic_string<char>, std::pair<const std::__cxx11::basic_string<char>, unsigned long>, std::_Select1st<std::pair<const std::__cxx11::basic_string<char>, unsigned long>>, std::less<std::__cxx11::basic_string<char>>>::_Rb_tree_impl" = type { [8 x i8], %"struct.std::_Rb_tree_header" }
%"class.std::__cxx11::basic_string" = type { %"struct.std::__cxx11::basic_string<char>::_Alloc_hider", i64, %union.anon }
%"struct.std::__cxx11::basic_string<char>::_Alloc_hider" = type { ptr }
%union.anon = type { i64, [8 x i8] }
%"class.std::allocator" = type { i8 }
%"struct.mjolnir::LennardJonesAttractivePotential<double>::parameter_type" = type { double, double }
%"class.boost::unit_test::basic_cstring" = type { ptr, ptr }
%"class.boost::test_tools::assertion_result" = type { %"class.boost::test_tools::assertion_result::readonly_property65", %"class.boost::shared_ptr.225" }
%"class.boost::test_tools::assertion_result::readonly_property65" = type { %"class.boost::unit_test::readonly_property.213" }
%"class.boost::unit_test::readonly_property.213" = type { %"class.boost::unit_test::class_property.98" }
%"class.boost::unit_test::class_property.98" = type { i8 }
%"class.boost::shared_ptr.225" = type { ptr, %"class.boost::detail::shared_count" }
%"class.boost::detail::shared_count" = type { ptr }
%"class.boost::test_tools::assertion::binary_expr.364" = type { %"class.boost::test_tools::assertion::value_expr.366", ptr }
%"class.boost::test_tools::assertion::value_expr.366" = type { ptr }
%"class.boost::test_tools::assertion::seed" = type { i8 }

@_ZN5boost9unit_test12_GLOBAL__N_113unit_test_logE = external hidden local_unnamed_addr global ptr, align 8
@.str.401 = external hidden unnamed_addr constant [106 x i8], align 1
@.str.409 = external hidden unnamed_addr constant [8 x i8], align 1
@.str.410 = external hidden unnamed_addr constant [29 x i8], align 1
@.str.411 = external hidden unnamed_addr constant [89 x i8], align 1

; Function Attrs: mustprogress nocallback nofree nosync nounwind willreturn memory(argmem: readwrite)
declare void @llvm.lifetime.start.p0(i64 immarg, ptr nocapture) #0

declare i32 @__gxx_personality_v0(...)

; Function Attrs: mustprogress nocallback nofree nosync nounwind willreturn memory(argmem: readwrite)
declare void @llvm.lifetime.end.p0(i64 immarg, ptr nocapture) #0

; Function Attrs: mustprogress nounwind uwtable
declare void @_ZNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEED2Ev(ptr noundef nonnull align 8 dereferenceable(32)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare void @_ZNSaIcEC2Ev(ptr noundef nonnull align 1 dereferenceable(1)) unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEC2IS3_EEPKcRKS3_(ptr noundef nonnull align 8 dereferenceable(32), ptr noundef, ptr noundef nonnull align 1 dereferenceable(1)) unnamed_addr #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16), ptr noundef, i64 noundef) unnamed_addr #1 align 2

; Function Attrs: mustprogress nocallback nofree nounwind willreturn memory(argmem: write)
declare void @llvm.memset.p0.i64(ptr nocapture writeonly, i8, i64, i1 immarg) #3

; Function Attrs: inlinehint mustprogress nounwind uwtable
declare dso_local void @_ZN5boost9unit_test13basic_cstringIKcEC2Ev(ptr noundef nonnull align 8 dereferenceable(16)) unnamed_addr #4 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local noundef nonnull align 8 dereferenceable(9) ptr @_ZN5boost9unit_test12lazy_ostream8instanceEv() local_unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local noundef zeroext i1 @_ZN5boost10test_tools9tt_detail16report_assertionERKNS0_16assertion_resultERKNS_9unit_test12lazy_ostreamENS5_13basic_cstringIKcEEmNS1_10tool_levelENS1_10check_typeEmz(ptr noundef nonnull align 8 dereferenceable(24), ptr noundef nonnull align 8 dereferenceable(9), ptr noundef, i64 noundef, i32 noundef, i32 noundef, i64 noundef, ...) local_unnamed_addr #2

; Function Attrs: inlinehint mustprogress nounwind uwtable
declare dso_local void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24)) unnamed_addr #4 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZN5boost9unit_test15unit_test_log_t14set_checkpointENS0_13basic_cstringIKcEEmS4_(ptr noundef nonnull align 8 dereferenceable(8), ptr noundef, i64 noundef, ptr noundef) local_unnamed_addr #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZN7mjolnir31LennardJonesAttractivePotentialIdEC2Ed(ptr noundef nonnull align 8 dereferenceable(16), double noundef) unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZNK5boost10test_tools9assertion4seedpmIdEENS1_10value_exprIT_EEOS5_(ptr dead_on_unwind noalias writable sret(%"class.boost::test_tools::assertion::value_expr") align 8, ptr noundef nonnull align 1 dereferenceable(1), ptr noundef nonnull align 8 dereferenceable(8)) local_unnamed_addr #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local noundef double @_ZNK7mjolnir31LennardJonesAttractivePotentialIdE9potentialEdRKNS1_14parameter_typeE(ptr noundef nonnull align 8 dereferenceable(16), double noundef, ptr noundef nonnull align 8 dereferenceable(16)) local_unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZN5boost10test_tools9assertion15expression_baseINS1_10value_exprIdEEdEeqIdEENS1_11binary_exprIS4_T_NS1_2op2EQIdNS5_4RhsTIS8_E4typeEvEEEEOS8_(ptr dead_on_unwind noalias writable sret(%"class.boost::test_tools::assertion::binary_expr") align 8, ptr noundef nonnull align 1 dereferenceable(1), ptr noundef nonnull align 8 dereferenceable(8)) local_unnamed_addr #2 align 2

; Function Attrs: inlinehint mustprogress uwtable
declare dso_local void @_ZN5boost9unit_testlsINS0_13basic_cstringIKcEEEENS0_17lazy_ostream_implINS0_12lazy_ostreamET_RKS7_EERKS6_S9_(ptr dead_on_unwind noalias writable sret(%"class.boost::unit_test::lazy_ostream_impl.320") align 8, ptr noundef nonnull align 8 dereferenceable(9), ptr noundef nonnull align 8 dereferenceable(16)) local_unnamed_addr #5

; Function Attrs: inlinehint mustprogress nounwind uwtable
declare dso_local noundef zeroext i1 @_ZN5boost10test_tools9tt_detail10dummy_condEv() local_unnamed_addr #4

; Function Attrs: mustprogress uwtable
define dso_local void @_ZN16LJ_cutoff_length11test_methodEv(ptr nocapture noundef nonnull readnone align 1 dereferenceable(1) %0) local_unnamed_addr #2 align 2 personality ptr @__gxx_personality_v0 {
  %2 = alloca %"class.mjolnir::LennardJonesAttractivePotential", align 8
  %3 = alloca %"class.std::vector.329", align 8
  %4 = alloca %"class.std::allocator.331", align 1
  %5 = alloca %"class.mjolnir::LorentzBerthelotRule", align 8
  %6 = alloca %"class.std::map.358", align 8
  %7 = alloca %"class.mjolnir::IgnoreMolecule", align 8
  %8 = alloca %"class.std::__cxx11::basic_string", align 8
  %9 = alloca %"class.std::allocator", align 1
  %10 = alloca %"class.mjolnir::IgnoreGroup", align 8
  %11 = alloca %"class.std::map.343", align 8
  %12 = alloca double, align 8
  %13 = alloca double, align 8
  %14 = alloca double, align 8
  %15 = alloca %"struct.mjolnir::LennardJonesAttractivePotential<double>::parameter_type", align 8
  %16 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %17 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %18 = alloca %"class.boost::test_tools::assertion_result", align 8
  %19 = alloca %"class.boost::test_tools::assertion::binary_expr.364", align 8
  %20 = alloca %"class.boost::test_tools::assertion::value_expr.366", align 8
  %21 = alloca %"class.boost::test_tools::assertion::seed", align 1
  %22 = alloca %"class.boost::unit_test::lazy_ostream_impl.320", align 8
  %23 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %24 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %25 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %26 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %27 = alloca %"class.boost::test_tools::assertion_result", align 8
  %28 = alloca %"class.boost::test_tools::assertion::binary_expr", align 8
  %29 = alloca %"class.boost::test_tools::assertion::value_expr", align 8
  %30 = alloca %"class.boost::test_tools::assertion::seed", align 1
  %31 = alloca double, align 8
  %32 = alloca %"struct.mjolnir::LennardJonesAttractivePotential<double>::parameter_type", align 8
  %33 = alloca double, align 8
  %34 = alloca %"class.boost::unit_test::lazy_ostream_impl.320", align 8
  %35 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %36 = alloca %"class.boost::unit_test::basic_cstring", align 8
  call void @llvm.lifetime.start.p0(i64 16, ptr nonnull %2) #6
  call void @_ZN7mjolnir31LennardJonesAttractivePotentialIdEC2Ed(ptr noundef nonnull align 8 dereferenceable(16) %2, double noundef 2.500000e+00) #6
  call void @llvm.lifetime.start.p0(i64 24, ptr nonnull %3) #6
  call void @llvm.lifetime.start.p0(i64 1, ptr nonnull %4) #6
  call void @_ZNSaISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEEEC2Ev(ptr noundef nonnull align 1 dereferenceable(1) %4) #6
  invoke void @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EEC2EmRKS6_(ptr noundef nonnull align 8 dereferenceable(24) %3, i64 noundef 10, ptr noundef nonnull align 1 dereferenceable(1) %4)
          to label %37 unwind label %39

37:                                               ; preds = %1
  call void @_ZNSt15__new_allocatorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEEED2Ev(ptr noundef nonnull align 1 dereferenceable(1) %4) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr nonnull %4) #6
  %38 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %3) #6
  %.not = icmp eq i64 %38, 0
  br i1 %.not, label %._crit_edge, label %.lr.ph

._crit_edge:                                      ; preds = %47, %37
  call void @llvm.lifetime.start.p0(i64 384, ptr nonnull %5) #6
  call void @llvm.lifetime.start.p0(i64 48, ptr nonnull %6) #6
  call void @llvm.memset.p0.i64(ptr noundef nonnull align 8 dereferenceable(48) %6, i8 0, i64 48, i1 false)
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessIS5_ESaISt4pairIKS5_mEEEC2Ev(ptr noundef nonnull align 8 dereferenceable(48) %6) #6
  call void @llvm.lifetime.start.p0(i64 32, ptr nonnull %8) #6
  call void @llvm.lifetime.start.p0(i64 1, ptr nonnull %9) #6
  call void @_ZNSaIcEC2Ev(ptr noundef nonnull align 1 dereferenceable(1) %9) #6
  invoke void @_ZNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEC2IS3_EEPKcRKS3_(ptr noundef nonnull align 8 dereferenceable(32) %8, ptr noundef nonnull @.str.409, ptr noundef nonnull align 1 dereferenceable(1) %9)
          to label %56 unwind label %68

39:                                               ; preds = %1
  %40 = landingpad { ptr, i32 }
          cleanup
  call void @_ZNSt15__new_allocatorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEEED2Ev(ptr noundef nonnull align 1 dereferenceable(1) %4) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr nonnull %4) #6
  br label %156

.lr.ph:                                           ; preds = %37, %47
  %.03959 = phi i64 [ %51, %47 ], [ 0, %37 ]
  %41 = invoke noundef nonnull align 8 dereferenceable(24) ptr @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE2atEm(ptr noundef nonnull align 8 dereferenceable(24) %3, i64 noundef %.03959)
          to label %42 unwind label %54

42:                                               ; preds = %.lr.ph
  store i64 %.03959, ptr %41, align 8, !tbaa !5
  %43 = invoke noundef nonnull align 8 dereferenceable(24) ptr @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE2atEm(ptr noundef nonnull align 8 dereferenceable(24) %3, i64 noundef %.03959)
          to label %44 unwind label %54

44:                                               ; preds = %42
  %45 = getelementptr inbounds i8, ptr %43, i64 16
  store double 1.000000e+00, ptr %45, align 8, !tbaa !12
  %46 = invoke noundef nonnull align 8 dereferenceable(24) ptr @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE2atEm(ptr noundef nonnull align 8 dereferenceable(24) %3, i64 noundef %.03959)
          to label %47 unwind label %54

47:                                               ; preds = %44
  %48 = uitofp i64 %.03959 to double
  %49 = fadd double %48, 1.000000e+00
  %50 = getelementptr inbounds i8, ptr %46, i64 8
  store double %49, ptr %50, align 8, !tbaa !13
  %51 = add nuw i64 %.03959, 1
  %52 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %3) #6
  %53 = icmp ult i64 %51, %52
  br i1 %53, label %.lr.ph, label %._crit_edge, !llvm.loop !14

54:                                               ; preds = %44, %42, %.lr.ph
  %55 = landingpad { ptr, i32 }
          cleanup
  br label %155

56:                                               ; preds = %._crit_edge
  invoke void @_ZN7mjolnir14IgnoreMoleculeImEC2ERKNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE(ptr noundef nonnull align 8 dereferenceable(8) %7, ptr noundef nonnull align 8 dereferenceable(32) %8)
          to label %57 unwind label %70

57:                                               ; preds = %56
  call void @llvm.lifetime.start.p0(i64 48, ptr nonnull %11) #6
  call void @llvm.memset.p0.i64(ptr noundef nonnull align 8 dereferenceable(48) %11, i8 0, i64 48, i1 false)
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEESt6vectorIS5_SaIS5_EESt4lessIS5_ESaISt4pairIKS5_S8_EEEC2Ev(ptr noundef nonnull align 8 dereferenceable(48) %11) #6
  invoke void @_ZN7mjolnir11IgnoreGroupINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEEC2ERKSt3mapIS6_St6vectorIS6_SaIS6_EESt4lessIS6_ESaISt4pairIKS6_SB_EEE(ptr noundef nonnull align 8 dereferenceable(72) %10, ptr noundef nonnull align 8 dereferenceable(48) %11)
          to label %58 unwind label %72

58:                                               ; preds = %57
  invoke void @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEEC2ERKSt6vectorISt4pairImNS5_14parameter_typeEESaISA_EERKSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessISL_ESaIS8_IKSL_mEEENS_14IgnoreMoleculeImEENS_11IgnoreGroupISL_EE(ptr noundef nonnull align 8 dereferenceable(384) %5, ptr noundef nonnull align 8 dereferenceable(24) %3, ptr noundef nonnull align 8 dereferenceable(48) %6, ptr noundef nonnull %7, ptr noundef nonnull %10)
          to label %59 unwind label %74

59:                                               ; preds = %58
  call void @_ZN7mjolnir11IgnoreGroupINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEED2Ev(ptr noundef nonnull align 8 dereferenceable(72) %10) #6
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEESt6vectorIS5_SaIS5_EESt4lessIS5_ESaISt4pairIKS5_S8_EEED2Ev(ptr noundef nonnull align 8 dereferenceable(48) %11) #6
  call void @llvm.lifetime.end.p0(i64 48, ptr nonnull %11) #6
  call void @_ZN7mjolnir14IgnoreMoleculeImED2Ev(ptr noundef nonnull align 8 dereferenceable(8) %7) #6
  call void @_ZNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEED2Ev(ptr noundef nonnull align 8 dereferenceable(32) %8) #6
  call void @_ZNSt15__new_allocatorIcED2Ev(ptr noundef nonnull align 1 dereferenceable(1) %9) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr nonnull %9) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr nonnull %8) #6
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessIS5_ESaISt4pairIKS5_mEEED2Ev(ptr noundef nonnull align 8 dereferenceable(48) %6) #6
  call void @llvm.lifetime.end.p0(i64 48, ptr nonnull %6) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr nonnull %12) #6
  %60 = call noundef nonnull align 8 dereferenceable(24) ptr @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEE10parametersEv(ptr noundef nonnull align 8 dereferenceable(384) %5) #6
  %61 = call ptr @_ZNSt6vectorIN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeESaIS3_EE5beginEv(ptr noundef nonnull align 8 dereferenceable(24) %60) #6
  %62 = call noundef nonnull align 8 dereferenceable(24) ptr @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEE10parametersEv(ptr noundef nonnull align 8 dereferenceable(384) %5) #6
  %63 = call ptr @_ZNSt6vectorIN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeESaIS3_EE3endEv(ptr noundef nonnull align 8 dereferenceable(24) %62) #6
  %64 = call noundef double @_ZNK7mjolnir31LennardJonesAttractivePotentialIdE10max_cutoffIN9__gnu_cxx17__normal_iteratorIPNS1_14parameter_typeESt6vectorIS5_SaIS5_EEEEEEdT_SB_(ptr noundef nonnull align 8 dereferenceable(16) %2, ptr %61, ptr %63) #6
  store double %64, ptr %12, align 8, !tbaa !16
  call void @llvm.lifetime.start.p0(i64 8, ptr nonnull %13) #6
  store double 0.000000e+00, ptr %13, align 8, !tbaa !16
  %65 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %3) #6
  %.not68 = icmp eq i64 %65, 0
  br i1 %.not68, label %.preheader57.preheader, label %.preheader58.lr.ph

.preheader57.preheader:                           ; preds = %._crit_edge62, %59
  br label %.preheader57

.preheader58.lr.ph:                               ; preds = %59
  %66 = getelementptr inbounds i8, ptr %15, i64 8
  br label %.preheader58

.preheader58:                                     ; preds = %.preheader58.lr.ph, %._crit_edge62
  %.02563 = phi i64 [ 0, %.preheader58.lr.ph ], [ %79, %._crit_edge62 ]
  %67 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %3) #6
  %.not69 = icmp eq i64 %67, 0
  br i1 %.not69, label %._crit_edge62, label %.lr.ph61

68:                                               ; preds = %._crit_edge
  %69 = landingpad { ptr, i32 }
          cleanup
  br label %78

70:                                               ; preds = %56
  %71 = landingpad { ptr, i32 }
          cleanup
  br label %77

72:                                               ; preds = %57
  %73 = landingpad { ptr, i32 }
          cleanup
  br label %76

74:                                               ; preds = %58
  %75 = landingpad { ptr, i32 }
          cleanup
  call void @_ZN7mjolnir11IgnoreGroupINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEED2Ev(ptr noundef nonnull align 8 dereferenceable(72) %10) #6
  br label %76

76:                                               ; preds = %74, %72
  %.pn = phi { ptr, i32 } [ %75, %74 ], [ %73, %72 ]
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEESt6vectorIS5_SaIS5_EESt4lessIS5_ESaISt4pairIKS5_S8_EEED2Ev(ptr noundef nonnull align 8 dereferenceable(48) %11) #6
  call void @llvm.lifetime.end.p0(i64 48, ptr nonnull %11) #6
  call void @_ZN7mjolnir14IgnoreMoleculeImED2Ev(ptr noundef nonnull align 8 dereferenceable(8) %7) #6
  br label %77

77:                                               ; preds = %76, %70
  %.pn.pn = phi { ptr, i32 } [ %.pn, %76 ], [ %71, %70 ]
  call void @_ZNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEED2Ev(ptr noundef nonnull align 8 dereferenceable(32) %8) #6
  br label %78

78:                                               ; preds = %77, %68
  %.pn.pn.pn = phi { ptr, i32 } [ %.pn.pn, %77 ], [ %69, %68 ]
  call void @_ZNSt15__new_allocatorIcED2Ev(ptr noundef nonnull align 1 dereferenceable(1) %9) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr nonnull %9) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr nonnull %8) #6
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessIS5_ESaISt4pairIKS5_mEEED2Ev(ptr noundef nonnull align 8 dereferenceable(48) %6) #6
  call void @llvm.lifetime.end.p0(i64 48, ptr nonnull %6) #6
  br label %154

._crit_edge62:                                    ; preds = %.lr.ph61, %.preheader58
  %79 = add nuw i64 %.02563, 1
  %80 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %3) #6
  %81 = icmp ult i64 %79, %80
  br i1 %81, label %.preheader58, label %.preheader57.preheader, !llvm.loop !17

.lr.ph61:                                         ; preds = %.preheader58, %.lr.ph61
  %.02460 = phi i64 [ %88, %.lr.ph61 ], [ 0, %.preheader58 ]
  call void @llvm.lifetime.start.p0(i64 8, ptr nonnull %14) #6
  call void @llvm.lifetime.start.p0(i64 16, ptr nonnull %15) #6
  %82 = call { double, double } @_ZNK7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEE14prepare_paramsEmm(ptr noundef nonnull align 8 dereferenceable(384) %5, i64 noundef %.02563, i64 noundef %.02460) #6
  %83 = extractvalue { double, double } %82, 0
  store double %83, ptr %15, align 8
  %84 = extractvalue { double, double } %82, 1
  store double %84, ptr %66, align 8
  %85 = call noundef double @_ZNK7mjolnir31LennardJonesAttractivePotentialIdE15absolute_cutoffERKNS1_14parameter_typeE(ptr noundef nonnull align 8 dereferenceable(16) %2, ptr noundef nonnull align 8 dereferenceable(16) %15) #6
  store double %85, ptr %14, align 8, !tbaa !16
  %86 = call noundef nonnull align 8 dereferenceable(8) ptr @_ZSt3maxIdERKT_S2_S2_(ptr noundef nonnull align 8 dereferenceable(8) %13, ptr noundef nonnull align 8 dereferenceable(8) %14)
  %87 = load double, ptr %86, align 8, !tbaa !16
  store double %87, ptr %13, align 8, !tbaa !16
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %15) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %14) #6
  %88 = add nuw i64 %.02460, 1
  %89 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %3) #6
  %90 = icmp ult i64 %88, %89
  br i1 %90, label %.lr.ph61, label %._crit_edge62, !llvm.loop !18

.preheader57:                                     ; preds = %.preheader57.preheader, %99
  %91 = load ptr, ptr @_ZN5boost9unit_test12_GLOBAL__N_113unit_test_logE, align 8, !tbaa !19
  call void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %16, ptr noundef nonnull @.str.401, i64 noundef 105)
  call void @_ZN5boost9unit_test13basic_cstringIKcEC2Ev(ptr noundef nonnull align 8 dereferenceable(16) %17)
  invoke void @_ZN5boost9unit_test15unit_test_log_t14set_checkpointENS0_13basic_cstringIKcEEmS4_(ptr noundef nonnull align 8 dereferenceable(8) %91, ptr noundef nonnull %16, i64 noundef 110, ptr noundef nonnull %17)
          to label %92 unwind label %106

92:                                               ; preds = %.preheader57
  call void @llvm.lifetime.start.p0(i64 24, ptr nonnull %18) #6
  call void @llvm.lifetime.start.p0(i64 16, ptr nonnull %19) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr nonnull %20) #6
  call void @llvm.lifetime.start.p0(i64 1, ptr nonnull %21) #6
  invoke void @_ZNK5boost10test_tools9assertion4seedpmIRdEENS1_10value_exprIT_EEOS6_(ptr dead_on_unwind nonnull writable sret(%"class.boost::test_tools::assertion::value_expr.366") align 8 %20, ptr noundef nonnull align 1 dereferenceable(1) %21, ptr noundef nonnull align 8 dereferenceable(8) %13)
          to label %93 unwind label %108

93:                                               ; preds = %92
  invoke void @_ZN5boost10test_tools9assertion15expression_baseINS1_10value_exprIRdEEdEleIRKdEENS1_11binary_exprIS5_T_NS1_2op2LEIdNS6_4RhsTISB_E4typeEvEEEEOSB_(ptr dead_on_unwind nonnull writable sret(%"class.boost::test_tools::assertion::binary_expr.364") align 8 %19, ptr noundef nonnull align 1 dereferenceable(1) %20, ptr noundef nonnull align 8 dereferenceable(8) %12)
          to label %94 unwind label %108

94:                                               ; preds = %93
  invoke void @_ZNK5boost10test_tools9assertion11binary_exprINS1_10value_exprIRdEERKdNS1_2op2LEIddvEEE8evaluateEb(ptr dead_on_unwind nonnull writable sret(%"class.boost::test_tools::assertion_result") align 8 %18, ptr noundef nonnull align 8 dereferenceable(16) %19, i1 noundef zeroext false)
          to label %95 unwind label %108

95:                                               ; preds = %94
  call void @llvm.lifetime.start.p0(i64 32, ptr nonnull %22) #6
  %96 = call noundef nonnull align 8 dereferenceable(9) ptr @_ZN5boost9unit_test12lazy_ostream8instanceEv()
  call void @llvm.lifetime.start.p0(i64 16, ptr nonnull %23) #6
  call void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %23, ptr noundef nonnull @.str.410, i64 noundef 28)
  invoke void @_ZN5boost9unit_testlsINS0_13basic_cstringIKcEEEENS0_17lazy_ostream_implINS0_12lazy_ostreamET_RKS7_EERKS6_S9_(ptr dead_on_unwind nonnull writable sret(%"class.boost::unit_test::lazy_ostream_impl.320") align 8 %22, ptr noundef nonnull align 8 dereferenceable(9) %96, ptr noundef nonnull align 8 dereferenceable(16) %23)
          to label %97 unwind label %110

97:                                               ; preds = %95
  call void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %24, ptr noundef nonnull @.str.401, i64 noundef 105)
  %98 = invoke noundef zeroext i1 (ptr, ptr, ptr, i64, i32, i32, i64, ...) @_ZN5boost10test_tools9tt_detail16report_assertionERKNS0_16assertion_resultERKNS_9unit_test12lazy_ostreamENS5_13basic_cstringIKcEEmNS1_10tool_levelENS1_10check_typeEmz(ptr noundef nonnull align 8 dereferenceable(24) %18, ptr noundef nonnull align 8 dereferenceable(9) %22, ptr noundef nonnull %24, i64 noundef 110, i32 noundef 1, i32 noundef 14, i64 noundef 0)
          to label %99 unwind label %112

99:                                               ; preds = %97
  call void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(32) %22) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %23) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr nonnull %22) #6
  call void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24) %18) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr nonnull %21) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %20) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %19) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr nonnull %18) #6
  %100 = call noundef zeroext i1 @_ZN5boost10test_tools9tt_detail10dummy_condEv()
  br i1 %100, label %.preheader57, label %101, !llvm.loop !21

101:                                              ; preds = %99
  %102 = call noundef double @_ZNSt14numeric_limitsIdE7epsilonEv() #6
  %103 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %3) #6
  %.not70 = icmp eq i64 %103, 0
  br i1 %.not70, label %._crit_edge67, label %.preheader56.lr.ph

.preheader56.lr.ph:                               ; preds = %101
  %104 = getelementptr inbounds i8, ptr %32, i64 8
  br label %.preheader56

.preheader56:                                     ; preds = %.preheader56.lr.ph, %._crit_edge65
  %.02266 = phi i64 [ 0, %.preheader56.lr.ph ], [ %116, %._crit_edge65 ]
  %105 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %3) #6
  %.not71 = icmp eq i64 %105, 0
  br i1 %.not71, label %._crit_edge65, label %.preheader

._crit_edge67:                                    ; preds = %._crit_edge65, %101
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %13) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %12) #6
  call void @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEED2Ev(ptr noundef nonnull align 8 dereferenceable(384) %5) #6
  call void @llvm.lifetime.end.p0(i64 384, ptr nonnull %5) #6
  call void @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EED2Ev(ptr noundef nonnull align 8 dereferenceable(24) %3) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr nonnull %3) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %2) #6
  ret void

106:                                              ; preds = %.preheader57
  %107 = landingpad { ptr, i32 }
          cleanup
  br label %153

108:                                              ; preds = %94, %93, %92
  %109 = landingpad { ptr, i32 }
          cleanup
  br label %115

110:                                              ; preds = %95
  %111 = landingpad { ptr, i32 }
          cleanup
  br label %114

112:                                              ; preds = %97
  %113 = landingpad { ptr, i32 }
          cleanup
  call void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(32) %22) #6
  br label %114

114:                                              ; preds = %112, %110
  %.pn43 = phi { ptr, i32 } [ %113, %112 ], [ %111, %110 ]
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %23) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr nonnull %22) #6
  call void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24) %18) #6
  br label %115

115:                                              ; preds = %114, %108
  %.pn43.pn = phi { ptr, i32 } [ %.pn43, %114 ], [ %109, %108 ]
  call void @llvm.lifetime.end.p0(i64 1, ptr nonnull %21) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %20) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %19) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr nonnull %18) #6
  br label %153

.preheader:                                       ; preds = %.preheader56, %136
  %.064 = phi i64 [ %137, %136 ], [ 0, %.preheader56 ]
  br label %119

._crit_edge65:                                    ; preds = %136, %.preheader56
  %116 = add nuw i64 %.02266, 1
  %117 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %3) #6
  %118 = icmp ult i64 %116, %117
  br i1 %118, label %.preheader56, label %._crit_edge67, !llvm.loop !22

119:                                              ; preds = %.preheader, %134
  %120 = load ptr, ptr @_ZN5boost9unit_test12_GLOBAL__N_113unit_test_logE, align 8, !tbaa !19
  call void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %25, ptr noundef nonnull @.str.401, i64 noundef 105)
  call void @_ZN5boost9unit_test13basic_cstringIKcEC2Ev(ptr noundef nonnull align 8 dereferenceable(16) %26)
  invoke void @_ZN5boost9unit_test15unit_test_log_t14set_checkpointENS0_13basic_cstringIKcEEmS4_(ptr noundef nonnull align 8 dereferenceable(8) %120, ptr noundef nonnull %25, i64 noundef 117, ptr noundef nonnull %26)
          to label %121 unwind label %140

121:                                              ; preds = %119
  call void @llvm.lifetime.start.p0(i64 24, ptr nonnull %27) #6
  call void @llvm.lifetime.start.p0(i64 16, ptr nonnull %28) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr nonnull %29) #6
  call void @llvm.lifetime.start.p0(i64 1, ptr nonnull %30) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr nonnull %31) #6
  %122 = load double, ptr %13, align 8, !tbaa !16
  %123 = fmul double %122, 0x3FF0000000000001
  call void @llvm.lifetime.start.p0(i64 16, ptr nonnull %32) #6
  %124 = call { double, double } @_ZNK7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEE14prepare_paramsEmm(ptr noundef nonnull align 8 dereferenceable(384) %5, i64 noundef %.02266, i64 noundef %.064) #6
  %125 = extractvalue { double, double } %124, 0
  store double %125, ptr %32, align 8
  %126 = extractvalue { double, double } %124, 1
  store double %126, ptr %104, align 8
  %127 = call noundef double @_ZNK7mjolnir31LennardJonesAttractivePotentialIdE9potentialEdRKNS1_14parameter_typeE(ptr noundef nonnull align 8 dereferenceable(16) %2, double noundef %123, ptr noundef nonnull align 8 dereferenceable(16) %32) #6
  store double %127, ptr %31, align 8, !tbaa !16
  invoke void @_ZNK5boost10test_tools9assertion4seedpmIdEENS1_10value_exprIT_EEOS5_(ptr dead_on_unwind nonnull writable sret(%"class.boost::test_tools::assertion::value_expr") align 8 %29, ptr noundef nonnull align 1 dereferenceable(1) %30, ptr noundef nonnull align 8 dereferenceable(8) %31)
          to label %128 unwind label %142

128:                                              ; preds = %121
  call void @llvm.lifetime.start.p0(i64 8, ptr nonnull %33) #6
  store double 0.000000e+00, ptr %33, align 8, !tbaa !16
  invoke void @_ZN5boost10test_tools9assertion15expression_baseINS1_10value_exprIdEEdEeqIdEENS1_11binary_exprIS4_T_NS1_2op2EQIdNS5_4RhsTIS8_E4typeEvEEEEOS8_(ptr dead_on_unwind nonnull writable sret(%"class.boost::test_tools::assertion::binary_expr") align 8 %28, ptr noundef nonnull align 1 dereferenceable(1) %29, ptr noundef nonnull align 8 dereferenceable(8) %33)
          to label %129 unwind label %144

129:                                              ; preds = %128
  invoke void @_ZNK5boost10test_tools9assertion11binary_exprINS1_10value_exprIdEEdNS1_2op2EQIddvEEE8evaluateEb(ptr dead_on_unwind nonnull writable sret(%"class.boost::test_tools::assertion_result") align 8 %27, ptr noundef nonnull align 8 dereferenceable(16) %28, i1 noundef zeroext false)
          to label %130 unwind label %144

130:                                              ; preds = %129
  call void @llvm.lifetime.start.p0(i64 32, ptr nonnull %34) #6
  %131 = call noundef nonnull align 8 dereferenceable(9) ptr @_ZN5boost9unit_test12lazy_ostream8instanceEv()
  call void @llvm.lifetime.start.p0(i64 16, ptr nonnull %35) #6
  call void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %35, ptr noundef nonnull @.str.411, i64 noundef 88)
  invoke void @_ZN5boost9unit_testlsINS0_13basic_cstringIKcEEEENS0_17lazy_ostream_implINS0_12lazy_ostreamET_RKS7_EERKS6_S9_(ptr dead_on_unwind nonnull writable sret(%"class.boost::unit_test::lazy_ostream_impl.320") align 8 %34, ptr noundef nonnull align 8 dereferenceable(9) %131, ptr noundef nonnull align 8 dereferenceable(16) %35)
          to label %132 unwind label %146

132:                                              ; preds = %130
  call void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %36, ptr noundef nonnull @.str.401, i64 noundef 105)
  %133 = invoke noundef zeroext i1 (ptr, ptr, ptr, i64, i32, i32, i64, ...) @_ZN5boost10test_tools9tt_detail16report_assertionERKNS0_16assertion_resultERKNS_9unit_test12lazy_ostreamENS5_13basic_cstringIKcEEmNS1_10tool_levelENS1_10check_typeEmz(ptr noundef nonnull align 8 dereferenceable(24) %27, ptr noundef nonnull align 8 dereferenceable(9) %34, ptr noundef nonnull %36, i64 noundef 117, i32 noundef 1, i32 noundef 14, i64 noundef 0)
          to label %134 unwind label %148

134:                                              ; preds = %132
  call void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(32) %34) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %35) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr nonnull %34) #6
  call void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24) %27) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %33) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %32) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %31) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr nonnull %30) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %29) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %28) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr nonnull %27) #6
  %135 = call noundef zeroext i1 @_ZN5boost10test_tools9tt_detail10dummy_condEv()
  br i1 %135, label %119, label %136, !llvm.loop !23

136:                                              ; preds = %134
  %137 = add nuw i64 %.064, 1
  %138 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %3) #6
  %139 = icmp ult i64 %137, %138
  br i1 %139, label %.preheader, label %._crit_edge65, !llvm.loop !24

140:                                              ; preds = %119
  %141 = landingpad { ptr, i32 }
          cleanup
  br label %153

142:                                              ; preds = %121
  %143 = landingpad { ptr, i32 }
          cleanup
  br label %152

144:                                              ; preds = %129, %128
  %145 = landingpad { ptr, i32 }
          cleanup
  br label %151

146:                                              ; preds = %130
  %147 = landingpad { ptr, i32 }
          cleanup
  br label %150

148:                                              ; preds = %132
  %149 = landingpad { ptr, i32 }
          cleanup
  call void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(32) %34) #6
  br label %150

150:                                              ; preds = %148, %146
  %.pn46 = phi { ptr, i32 } [ %149, %148 ], [ %147, %146 ]
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %35) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr nonnull %34) #6
  call void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24) %27) #6
  br label %151

151:                                              ; preds = %150, %144
  %.pn46.pn = phi { ptr, i32 } [ %.pn46, %150 ], [ %145, %144 ]
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %33) #6
  br label %152

152:                                              ; preds = %151, %142
  %.pn46.pn.pn = phi { ptr, i32 } [ %.pn46.pn, %151 ], [ %143, %142 ]
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %32) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %31) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr nonnull %30) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %29) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %28) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr nonnull %27) #6
  br label %153

153:                                              ; preds = %140, %152, %115, %106
  %.pn46.pn.pn.pn.pn = phi { ptr, i32 } [ %.pn43.pn, %115 ], [ %107, %106 ], [ %.pn46.pn.pn, %152 ], [ %141, %140 ]
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %13) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %12) #6
  call void @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEED2Ev(ptr noundef nonnull align 8 dereferenceable(384) %5) #6
  br label %154

154:                                              ; preds = %153, %78
  %.pn46.pn.pn.pn.pn.pn = phi { ptr, i32 } [ %.pn46.pn.pn.pn.pn, %153 ], [ %.pn.pn.pn, %78 ]
  call void @llvm.lifetime.end.p0(i64 384, ptr nonnull %5) #6
  br label %155

155:                                              ; preds = %154, %54
  %.pn53 = phi { ptr, i32 } [ %55, %54 ], [ %.pn46.pn.pn.pn.pn.pn, %154 ]
  call void @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EED2Ev(ptr noundef nonnull align 8 dereferenceable(24) %3) #6
  br label %156

156:                                              ; preds = %155, %39
  %.pn53.pn = phi { ptr, i32 } [ %.pn53, %155 ], [ %40, %39 ]
  call void @llvm.lifetime.end.p0(i64 24, ptr nonnull %3) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %2) #6
  resume { ptr, i32 } %.pn53.pn
}

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSaISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEEEC2Ev(ptr noundef nonnull align 1 dereferenceable(1)) unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EEC2EmRKS6_(ptr noundef nonnull align 8 dereferenceable(24), i64 noundef, ptr noundef nonnull align 1 dereferenceable(1)) unnamed_addr #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24)) local_unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local noundef nonnull align 8 dereferenceable(24) ptr @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EE2atEm(ptr noundef nonnull align 8 dereferenceable(24), i64 noundef) local_unnamed_addr #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessIS5_ESaISt4pairIKS5_mEEEC2Ev(ptr noundef nonnull align 8 dereferenceable(48)) unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZN7mjolnir14IgnoreMoleculeImEC2ERKNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE(ptr noundef nonnull align 8 dereferenceable(8), ptr noundef nonnull align 8 dereferenceable(32)) unnamed_addr #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEESt6vectorIS5_SaIS5_EESt4lessIS5_ESaISt4pairIKS5_S8_EEEC2Ev(ptr noundef nonnull align 8 dereferenceable(48)) unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZN7mjolnir11IgnoreGroupINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEEC2ERKSt3mapIS6_St6vectorIS6_SaIS6_EESt4lessIS6_ESaISt4pairIKS6_SB_EEE(ptr noundef nonnull align 8 dereferenceable(72), ptr noundef nonnull align 8 dereferenceable(48)) unnamed_addr #2 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEEC2ERKSt6vectorISt4pairImNS5_14parameter_typeEESaISA_EERKSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessISL_ESaIS8_IKSL_mEEENS_14IgnoreMoleculeImEENS_11IgnoreGroupISL_EE(ptr noundef nonnull align 8 dereferenceable(384), ptr noundef nonnull align 8 dereferenceable(24), ptr noundef nonnull align 8 dereferenceable(48), ptr noundef, ptr noundef) unnamed_addr #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZN7mjolnir11IgnoreGroupINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEED2Ev(ptr noundef nonnull align 8 dereferenceable(72)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEESt6vectorIS5_SaIS5_EESt4lessIS5_ESaISt4pairIKS5_S8_EEED2Ev(ptr noundef nonnull align 8 dereferenceable(48)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZN7mjolnir14IgnoreMoleculeImED2Ev(ptr noundef nonnull align 8 dereferenceable(8)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessIS5_ESaISt4pairIKS5_mEEED2Ev(ptr noundef nonnull align 8 dereferenceable(48)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local noundef double @_ZNK7mjolnir31LennardJonesAttractivePotentialIdE10max_cutoffIN9__gnu_cxx17__normal_iteratorIPNS1_14parameter_typeESt6vectorIS5_SaIS5_EEEEEEdT_SB_(ptr noundef nonnull align 8 dereferenceable(16), ptr, ptr) local_unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local noundef nonnull align 8 dereferenceable(24) ptr @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEE10parametersEv(ptr noundef nonnull align 8 dereferenceable(384)) local_unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local ptr @_ZNSt6vectorIN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeESaIS3_EE5beginEv(ptr noundef nonnull align 8 dereferenceable(24)) local_unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local ptr @_ZNSt6vectorIN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeESaIS3_EE3endEv(ptr noundef nonnull align 8 dereferenceable(24)) local_unnamed_addr #1 align 2

; Function Attrs: inlinehint mustprogress nounwind uwtable
declare dso_local noundef nonnull align 8 dereferenceable(8) ptr @_ZSt3maxIdERKT_S2_S2_(ptr noundef nonnull align 8 dereferenceable(8), ptr noundef nonnull align 8 dereferenceable(8)) local_unnamed_addr #4

; Function Attrs: mustprogress nounwind uwtable
declare dso_local noundef double @_ZNK7mjolnir31LennardJonesAttractivePotentialIdE15absolute_cutoffERKNS1_14parameter_typeE(ptr noundef nonnull align 8 dereferenceable(16), ptr noundef nonnull align 8 dereferenceable(16)) local_unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local { double, double } @_ZNK7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEE14prepare_paramsEmm(ptr noundef nonnull align 8 dereferenceable(384), i64 noundef, i64 noundef) unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZNK5boost10test_tools9assertion4seedpmIRdEENS1_10value_exprIT_EEOS6_(ptr dead_on_unwind noalias writable sret(%"class.boost::test_tools::assertion::value_expr.366") align 8, ptr noundef nonnull align 1 dereferenceable(1), ptr noundef nonnull align 8 dereferenceable(8)) local_unnamed_addr #2 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZN5boost10test_tools9assertion15expression_baseINS1_10value_exprIRdEEdEleIRKdEENS1_11binary_exprIS5_T_NS1_2op2LEIdNS6_4RhsTISB_E4typeEvEEEEOSB_(ptr dead_on_unwind noalias writable sret(%"class.boost::test_tools::assertion::binary_expr.364") align 8, ptr noundef nonnull align 1 dereferenceable(1), ptr noundef nonnull align 8 dereferenceable(8)) local_unnamed_addr #2 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZNK5boost10test_tools9assertion11binary_exprINS1_10value_exprIRdEERKdNS1_2op2LEIddvEEE8evaluateEb(ptr dead_on_unwind noalias writable sret(%"class.boost::test_tools::assertion_result") align 8, ptr noundef nonnull align 8 dereferenceable(16), i1 noundef zeroext) local_unnamed_addr #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local noundef double @_ZNSt14numeric_limitsIdE7epsilonEv() local_unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZNK5boost10test_tools9assertion11binary_exprINS1_10value_exprIdEEdNS1_2op2EQIddvEEE8evaluateEb(ptr dead_on_unwind noalias writable sret(%"class.boost::test_tools::assertion_result") align 8, ptr noundef nonnull align 8 dereferenceable(16), i1 noundef zeroext) local_unnamed_addr #2 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_31LennardJonesAttractivePotentialIdEEED2Ev(ptr noundef nonnull align 8 dereferenceable(384)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSt6vectorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEESaIS5_EED2Ev(ptr noundef nonnull align 8 dereferenceable(24)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSt15__new_allocatorIcED2Ev(ptr noundef nonnull align 1 dereferenceable(1)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(9)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSt15__new_allocatorISt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEEED2Ev(ptr noundef nonnull align 1 dereferenceable(1)) unnamed_addr #1 align 2

attributes #0 = { mustprogress nocallback nofree nosync nounwind willreturn memory(argmem: readwrite) }
attributes #1 = { mustprogress nounwind uwtable "min-legal-vector-width"="0" "no-trapping-math"="true" "stack-protector-buffer-size"="8" "target-cpu"="x86-64" "target-features"="+cmov,+cx8,+fxsr,+mmx,+sse,+sse2,+x87" "tune-cpu"="generic" }
attributes #2 = { mustprogress uwtable "min-legal-vector-width"="0" "no-trapping-math"="true" "stack-protector-buffer-size"="8" "target-cpu"="x86-64" "target-features"="+cmov,+cx8,+fxsr,+mmx,+sse,+sse2,+x87" "tune-cpu"="generic" }
attributes #3 = { mustprogress nocallback nofree nounwind willreturn memory(argmem: write) }
attributes #4 = { inlinehint mustprogress nounwind uwtable "min-legal-vector-width"="0" "no-trapping-math"="true" "stack-protector-buffer-size"="8" "target-cpu"="x86-64" "target-features"="+cmov,+cx8,+fxsr,+mmx,+sse,+sse2,+x87" "tune-cpu"="generic" }
attributes #5 = { inlinehint mustprogress uwtable "min-legal-vector-width"="0" "no-trapping-math"="true" "stack-protector-buffer-size"="8" "target-cpu"="x86-64" "target-features"="+cmov,+cx8,+fxsr,+mmx,+sse,+sse2,+x87" "tune-cpu"="generic" }
attributes #6 = { nounwind }

!llvm.module.flags = !{!0, !1, !2, !3}
!llvm.ident = !{!4}

!0 = !{i32 1, !"wchar_size", i32 4}
!1 = !{i32 8, !"PIC Level", i32 2}
!2 = !{i32 7, !"PIE Level", i32 2}
!3 = !{i32 7, !"uwtable", i32 2}
!4 = !{!"clang version 19.1.0 (git@github.com:llvm/llvm-project.git a4bf6cd7cfb1a1421ba92bca9d017b49936c55e4)"}
!5 = !{!6, !7, i64 0}
!6 = !{!"_ZTSSt4pairImN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeEE", !7, i64 0, !10, i64 8}
!7 = !{!"long", !8, i64 0}
!8 = !{!"omnipotent char", !9, i64 0}
!9 = !{!"Simple C++ TBAA"}
!10 = !{!"_ZTSN7mjolnir31LennardJonesAttractivePotentialIdE14parameter_typeE", !11, i64 0, !11, i64 8}
!11 = !{!"double", !8, i64 0}
!12 = !{!6, !11, i64 16}
!13 = !{!6, !11, i64 8}
!14 = distinct !{!14, !15}
!15 = !{!"llvm.loop.mustprogress"}
!16 = !{!11, !11, i64 0}
!17 = distinct !{!17, !15}
!18 = distinct !{!18, !15}
!19 = !{!20, !20, i64 0}
!20 = !{!"any pointer", !8, i64 0}
!21 = distinct !{!21, !15}
!22 = distinct !{!22, !15}
!23 = distinct !{!23, !15}
!24 = distinct !{!24, !15}


; Effective O3 passes: CorrelatedValuePropagationPass,EarlyCSEPass,GlobalOptPass,IndVarSimplifyPass,InferFunctionAttrsPass,InstCombinePass,JumpThreadingPass,LICMPass,LoopRotatePass,LoopSimplifyPass,LoopUnrollPass,PostOrderFunctionAttrsPass,SROAPass,SimplifyCFGPass