; LLVM IR from Mjolnir-MD/Mjolnir :: test/core/test_lennard_jones_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.mjolnir::LennardJonesPotential" = type { double, double }
%"class.std::vector.315" = type { %"struct.std::_Vector_base.316" }
%"struct.std::_Vector_base.316" = type { %"struct.std::_Vector_base<std::pair<unsigned long, mjolnir::LennardJonesPotential<double>::parameter_type>, std::allocator<std::pair<unsigned long, mjolnir::LennardJonesPotential<double>::parameter_type>>>::_Vector_impl" }
%"struct.std::_Vector_base<std::pair<unsigned long, mjolnir::LennardJonesPotential<double>::parameter_type>, std::allocator<std::pair<unsigned long, mjolnir::LennardJonesPotential<double>::parameter_type>>>::_Vector_impl" = type { %"struct.std::_Vector_base<std::pair<unsigned long, mjolnir::LennardJonesPotential<double>::parameter_type>, std::allocator<std::pair<unsigned long, mjolnir::LennardJonesPotential<double>::parameter_type>>>::_Vector_impl_data" }
%"struct.std::_Vector_base<std::pair<unsigned long, mjolnir::LennardJonesPotential<double>::parameter_type>, std::allocator<std::pair<unsigned long, mjolnir::LennardJonesPotential<double>::parameter_type>>>::_Vector_impl_data" = type { ptr, ptr, ptr }
%"class.std::allocator.317" = type { i8 }
%"class.mjolnir::LorentzBerthelotRule" = type { %"struct.mjolnir::ParameterListBase", double, %"class.std::vector.7", %"class.std::vector.322", %"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.322" = type { %"struct.std::_Vector_base.323" }
%"struct.std::_Vector_base.323" = type { %"struct.std::_Vector_base<mjolnir::LennardJonesPotential<double>::parameter_type, std::allocator<mjolnir::LennardJonesPotential<double>::parameter_type>>::_Vector_impl" }
%"struct.std::_Vector_base<mjolnir::LennardJonesPotential<double>::parameter_type, std::allocator<mjolnir::LennardJonesPotential<double>::parameter_type>>::_Vector_impl" = type { %"struct.std::_Vector_base<mjolnir::LennardJonesPotential<double>::parameter_type, std::allocator<mjolnir::LennardJonesPotential<double>::parameter_type>>::_Vector_impl_data" }
%"struct.std::_Vector_base<mjolnir::LennardJonesPotential<double>::parameter_type, std::allocator<mjolnir::LennardJonesPotential<double>::parameter_type>>::_Vector_impl_data" = type { ptr, ptr, ptr }
%"class.mjolnir::ExclusionList" = type { %"class.mjolnir::IgnoreMolecule", %"class.mjolnir::IgnoreGroup", %"class.std::vector.334", %"class.std::vector.7", %"class.std::vector", %"class.std::vector.7", %"class.std::vector.7", %"class.std::vector.339", %"class.std::vector.7", %"class.std::vector.339", %"class.std::vector.7", %"class.std::vector.339" }
%"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.328" }
%"struct.std::_Head_base.328" = type { ptr }
%"class.mjolnir::IgnoreGroup" = type { %"class.std::map.329", %"class.std::vector" }
%"class.std::map.329" = type { %"class.std::_Rb_tree.330" }
%"class.std::_Rb_tree.330" = 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.334" = type { %"struct.std::_Vector_base.335" }
%"struct.std::_Vector_base.335" = 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.339" = type { %"struct.std::_Vector_base.340" }
%"struct.std::_Vector_base.340" = 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.344" = type { %"class.std::_Rb_tree.345" }
%"class.std::_Rb_tree.345" = 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.349" = type { ptr }
%"struct.mjolnir::LennardJonesPotential<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" = type { %"class.boost::test_tools::assertion::value_expr", ptr }
%"class.boost::test_tools::assertion::value_expr" = type { ptr }
%"class.boost::test_tools::assertion::seed" = type { i8 }
%"class.boost::unit_test::lazy_ostream_impl.351" = type { %"class.boost::unit_test::lazy_ostream.base", ptr, ptr }
%"class.boost::unit_test::lazy_ostream.base" = type <{ ptr, i8 }>
%"class.boost::test_tools::assertion::binary_expr.352" = type { %"class.boost::test_tools::assertion::value_expr.354", double }
%"class.boost::test_tools::assertion::value_expr.354" = type { double }
%"struct.std::pair.320" = type { i64, %"struct.mjolnir::LennardJonesPotential<double>::parameter_type" }

@_ZN5boost9unit_test12_GLOBAL__N_113unit_test_logE = external hidden global ptr, align 8
@.str.401 = external hidden unnamed_addr constant [95 x i8], align 1
@.str.406 = external hidden unnamed_addr constant [8 x i8], align 1
@.str.407 = external hidden unnamed_addr constant [29 x i8], align 1
@.str.408 = 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 @_ZN7mjolnir21LennardJonesPotentialIdEC2ERKd(ptr noundef nonnull align 8 dereferenceable(16), ptr noundef nonnull align 8 dereferenceable(8)) unnamed_addr #1 align 2

; 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::LennardJonesPotential", align 8
  %4 = alloca double, align 8
  %5 = alloca %"class.std::vector.315", align 8
  %6 = alloca %"class.std::allocator.317", align 1
  %7 = alloca ptr, align 8
  %8 = alloca i32, align 4
  %9 = alloca i64, align 8
  %10 = alloca %"class.mjolnir::LorentzBerthelotRule", align 8
  %11 = alloca %"class.std::map.344", align 8
  %12 = alloca %"class.mjolnir::IgnoreMolecule", align 8
  %13 = alloca %"class.std::__cxx11::basic_string", align 8
  %14 = alloca %"class.std::allocator", align 1
  %15 = alloca %"class.mjolnir::IgnoreGroup", align 8
  %16 = alloca %"class.std::map.329", align 8
  %17 = alloca double, align 8
  %18 = alloca %"class.__gnu_cxx::__normal_iterator.349", align 8
  %19 = alloca %"class.__gnu_cxx::__normal_iterator.349", align 8
  %20 = alloca double, align 8
  %21 = alloca i64, align 8
  %22 = alloca i32, align 4
  %23 = alloca i64, align 8
  %24 = alloca double, align 8
  %25 = alloca %"struct.mjolnir::LennardJonesPotential<double>::parameter_type", align 8
  %26 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %27 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %28 = alloca %"class.boost::test_tools::assertion_result", align 8
  %29 = alloca %"class.boost::test_tools::assertion::binary_expr", align 8
  %30 = alloca %"class.boost::test_tools::assertion::value_expr", align 8
  %31 = alloca %"class.boost::test_tools::assertion::seed", align 1
  %32 = alloca %"class.boost::unit_test::lazy_ostream_impl.351", align 8
  %33 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %34 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %35 = alloca double, align 8
  %36 = alloca i64, align 8
  %37 = alloca i64, align 8
  %38 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %39 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %40 = alloca %"class.boost::test_tools::assertion_result", align 8
  %41 = alloca %"class.boost::test_tools::assertion::binary_expr.352", align 8
  %42 = alloca %"class.boost::test_tools::assertion::value_expr.354", align 8
  %43 = alloca %"class.boost::test_tools::assertion::seed", align 1
  %44 = alloca double, align 8
  %45 = alloca %"struct.mjolnir::LennardJonesPotential<double>::parameter_type", align 8
  %46 = alloca double, align 8
  %47 = alloca %"class.boost::unit_test::lazy_ostream_impl.351", align 8
  %48 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %49 = alloca %"class.boost::unit_test::basic_cstring", align 8
  store ptr %0, ptr %2, align 8, !tbaa !5
  %50 = load ptr, ptr %2, align 8
  call void @llvm.lifetime.start.p0(i64 16, ptr %3) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr %4) #6
  store double 2.500000e+00, ptr %4, align 8, !tbaa !9
  call void @_ZN7mjolnir21LennardJonesPotentialIdEC2ERKd(ptr noundef nonnull align 8 dereferenceable(16) %3, ptr noundef nonnull align 8 dereferenceable(8) %4) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %4) #6
  call void @llvm.lifetime.start.p0(i64 24, ptr %5) #6
  call void @llvm.lifetime.start.p0(i64 1, ptr %6) #6
  call void @_ZNSaISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEEEC2Ev(ptr noundef nonnull align 1 dereferenceable(1) %6) #6
  invoke void @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EEC2EmRKS6_(ptr noundef nonnull align 8 dereferenceable(24) %5, i64 noundef 10, ptr noundef nonnull align 1 dereferenceable(1) %6)
          to label %51 unwind label %57

51:                                               ; preds = %1
  call void @_ZNSt15__new_allocatorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEEED2Ev(ptr noundef nonnull align 1 dereferenceable(1) %6) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr %6) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr %9) #6
  store i64 0, ptr %9, align 8, !tbaa !11
  br label %52

52:                                               ; preds = %80, %51
  %53 = load i64, ptr %9, align 8, !tbaa !11
  %54 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %5) #6
  %55 = icmp ult i64 %53, %54
  br i1 %55, label %61, label %56

56:                                               ; preds = %52
  call void @llvm.lifetime.end.p0(i64 8, ptr %9) #6
  br label %87

57:                                               ; preds = %1
  %58 = landingpad { ptr, i32 }
          cleanup
  %59 = extractvalue { ptr, i32 } %58, 0
  store ptr %59, ptr %7, align 8
  %60 = extractvalue { ptr, i32 } %58, 1
  store i32 %60, ptr %8, align 4
  call void @_ZNSt15__new_allocatorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEEED2Ev(ptr noundef nonnull align 1 dereferenceable(1) %6) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr %6) #6
  br label %282

61:                                               ; preds = %52
  %62 = load i64, ptr %9, align 8, !tbaa !11
  %63 = load i64, ptr %9, align 8, !tbaa !11
  %64 = invoke noundef nonnull align 8 dereferenceable(24) ptr @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE2atEm(ptr noundef nonnull align 8 dereferenceable(24) %5, i64 noundef %63)
          to label %65 unwind label %83

65:                                               ; preds = %61
  %66 = getelementptr inbounds %"struct.std::pair.320", ptr %64, i32 0, i32 0
  store i64 %62, ptr %66, align 8, !tbaa !13
  %67 = load i64, ptr %9, align 8, !tbaa !11
  %68 = invoke noundef nonnull align 8 dereferenceable(24) ptr @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE2atEm(ptr noundef nonnull align 8 dereferenceable(24) %5, i64 noundef %67)
          to label %69 unwind label %83

69:                                               ; preds = %65
  %70 = getelementptr inbounds %"struct.std::pair.320", ptr %68, i32 0, i32 1
  %71 = getelementptr inbounds %"struct.mjolnir::LennardJonesPotential<double>::parameter_type", ptr %70, i32 0, i32 1
  store double 1.000000e+00, ptr %71, align 8, !tbaa !16
  %72 = load i64, ptr %9, align 8, !tbaa !11
  %73 = uitofp i64 %72 to double
  %74 = fadd double %73, 1.000000e+00
  %75 = load i64, ptr %9, align 8, !tbaa !11
  %76 = invoke noundef nonnull align 8 dereferenceable(24) ptr @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE2atEm(ptr noundef nonnull align 8 dereferenceable(24) %5, i64 noundef %75)
          to label %77 unwind label %83

77:                                               ; preds = %69
  %78 = getelementptr inbounds %"struct.std::pair.320", ptr %76, i32 0, i32 1
  %79 = getelementptr inbounds %"struct.mjolnir::LennardJonesPotential<double>::parameter_type", ptr %78, i32 0, i32 0
  store double %74, ptr %79, align 8, !tbaa !17
  br label %80

80:                                               ; preds = %77
  %81 = load i64, ptr %9, align 8, !tbaa !11
  %82 = add i64 %81, 1
  store i64 %82, ptr %9, align 8, !tbaa !11
  br label %52, !llvm.loop !18

83:                                               ; preds = %69, %65, %61
  %84 = landingpad { ptr, i32 }
          cleanup
  %85 = extractvalue { ptr, i32 } %84, 0
  store ptr %85, ptr %7, align 8
  %86 = extractvalue { ptr, i32 } %84, 1
  store i32 %86, ptr %8, align 4
  call void @llvm.lifetime.end.p0(i64 8, ptr %9) #6
  br label %281

87:                                               ; preds = %56
  call void @llvm.lifetime.start.p0(i64 384, ptr %10) #6
  call void @llvm.lifetime.start.p0(i64 48, ptr %11) #6
  call void @llvm.memset.p0.i64(ptr align 8 %11, i8 0, i64 48, i1 false)
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessIS5_ESaISt4pairIKS5_mEEEC2Ev(ptr noundef nonnull align 8 dereferenceable(48) %11) #6
  call void @llvm.lifetime.start.p0(i64 32, ptr %13) #6
  call void @llvm.lifetime.start.p0(i64 1, ptr %14) #6
  call void @_ZNSaIcEC2Ev(ptr noundef nonnull align 1 dereferenceable(1) %14) #6
  invoke void @_ZNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEC2IS3_EEPKcRKS3_(ptr noundef nonnull align 8 dereferenceable(32) %13, ptr noundef @.str.406, ptr noundef nonnull align 1 dereferenceable(1) %14)
          to label %88 unwind label %108

88:                                               ; preds = %87
  invoke void @_ZN7mjolnir14IgnoreMoleculeImEC2ERKNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE(ptr noundef nonnull align 8 dereferenceable(8) %12, ptr noundef nonnull align 8 dereferenceable(32) %13)
          to label %89 unwind label %112

89:                                               ; preds = %88
  call void @llvm.lifetime.start.p0(i64 48, ptr %16) #6
  call void @llvm.memset.p0.i64(ptr align 8 %16, i8 0, i64 48, i1 false)
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEESt6vectorIS5_SaIS5_EESt4lessIS5_ESaISt4pairIKS5_S8_EEEC2Ev(ptr noundef nonnull align 8 dereferenceable(48) %16) #6
  invoke void @_ZN7mjolnir11IgnoreGroupINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEEC2ERKSt3mapIS6_St6vectorIS6_SaIS6_EESt4lessIS6_ESaISt4pairIKS6_SB_EEE(ptr noundef nonnull align 8 dereferenceable(72) %15, ptr noundef nonnull align 8 dereferenceable(48) %16)
          to label %90 unwind label %116

90:                                               ; preds = %89
  invoke void @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_21LennardJonesPotentialIdEEEC2ERKSt6vectorISt4pairImNS5_14parameter_typeEESaISA_EERKSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessISL_ESaIS8_IKSL_mEEENS_14IgnoreMoleculeImEENS_11IgnoreGroupISL_EE(ptr noundef nonnull align 8 dereferenceable(384) %10, ptr noundef nonnull align 8 dereferenceable(24) %5, ptr noundef nonnull align 8 dereferenceable(48) %11, ptr noundef %12, ptr noundef %15)
          to label %91 unwind label %120

91:                                               ; preds = %90
  call void @_ZN7mjolnir11IgnoreGroupINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEED2Ev(ptr noundef nonnull align 8 dereferenceable(72) %15) #6
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEESt6vectorIS5_SaIS5_EESt4lessIS5_ESaISt4pairIKS5_S8_EEED2Ev(ptr noundef nonnull align 8 dereferenceable(48) %16) #6
  call void @llvm.lifetime.end.p0(i64 48, ptr %16) #6
  call void @_ZN7mjolnir14IgnoreMoleculeImED2Ev(ptr noundef nonnull align 8 dereferenceable(8) %12) #6
  call void @_ZNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEED2Ev(ptr noundef nonnull align 8 dereferenceable(32) %13) #6
  call void @_ZNSt15__new_allocatorIcED2Ev(ptr noundef nonnull align 1 dereferenceable(1) %14) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr %14) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr %13) #6
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessIS5_ESaISt4pairIKS5_mEEED2Ev(ptr noundef nonnull align 8 dereferenceable(48) %11) #6
  call void @llvm.lifetime.end.p0(i64 48, ptr %11) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr %17) #6
  %92 = call noundef nonnull align 8 dereferenceable(24) ptr @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_21LennardJonesPotentialIdEEE10parametersEv(ptr noundef nonnull align 8 dereferenceable(384) %10) #6
  %93 = call ptr @_ZNSt6vectorIN7mjolnir21LennardJonesPotentialIdE14parameter_typeESaIS3_EE5beginEv(ptr noundef nonnull align 8 dereferenceable(24) %92) #6
  %94 = getelementptr inbounds %"class.__gnu_cxx::__normal_iterator.349", ptr %18, i32 0, i32 0
  store ptr %93, ptr %94, align 8
  %95 = call noundef nonnull align 8 dereferenceable(24) ptr @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_21LennardJonesPotentialIdEEE10parametersEv(ptr noundef nonnull align 8 dereferenceable(384) %10) #6
  %96 = call ptr @_ZNSt6vectorIN7mjolnir21LennardJonesPotentialIdE14parameter_typeESaIS3_EE3endEv(ptr noundef nonnull align 8 dereferenceable(24) %95) #6
  %97 = getelementptr inbounds %"class.__gnu_cxx::__normal_iterator.349", ptr %19, i32 0, i32 0
  store ptr %96, ptr %97, align 8
  %98 = getelementptr inbounds %"class.__gnu_cxx::__normal_iterator.349", ptr %18, i32 0, i32 0
  %99 = load ptr, ptr %98, align 8
  %100 = getelementptr inbounds %"class.__gnu_cxx::__normal_iterator.349", ptr %19, i32 0, i32 0
  %101 = load ptr, ptr %100, align 8
  %102 = call noundef double @_ZNK7mjolnir21LennardJonesPotentialIdE10max_cutoffIN9__gnu_cxx17__normal_iteratorIPNS1_14parameter_typeESt6vectorIS5_SaIS5_EEEEEEdT_SB_(ptr noundef nonnull align 8 dereferenceable(16) %3, ptr %99, ptr %101) #6
  store double %102, ptr %17, align 8, !tbaa !9
  call void @llvm.lifetime.start.p0(i64 8, ptr %20) #6
  store double 0.000000e+00, ptr %20, align 8, !tbaa !9
  call void @llvm.lifetime.start.p0(i64 8, ptr %21) #6
  store i64 0, ptr %21, align 8, !tbaa !11
  br label %103

103:                                              ; preds = %153, %91
  %104 = load i64, ptr %21, align 8, !tbaa !11
  %105 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %5) #6
  %106 = icmp ult i64 %104, %105
  br i1 %106, label %127, label %107

107:                                              ; preds = %103
  store i32 5, ptr %22, align 4
  call void @llvm.lifetime.end.p0(i64 8, ptr %21) #6
  br label %156

108:                                              ; preds = %87
  %109 = landingpad { ptr, i32 }
          cleanup
  %110 = extractvalue { ptr, i32 } %109, 0
  store ptr %110, ptr %7, align 8
  %111 = extractvalue { ptr, i32 } %109, 1
  store i32 %111, ptr %8, align 4
  br label %126

112:                                              ; preds = %88
  %113 = landingpad { ptr, i32 }
          cleanup
  %114 = extractvalue { ptr, i32 } %113, 0
  store ptr %114, ptr %7, align 8
  %115 = extractvalue { ptr, i32 } %113, 1
  store i32 %115, ptr %8, align 4
  br label %125

116:                                              ; preds = %89
  %117 = landingpad { ptr, i32 }
          cleanup
  %118 = extractvalue { ptr, i32 } %117, 0
  store ptr %118, ptr %7, align 8
  %119 = extractvalue { ptr, i32 } %117, 1
  store i32 %119, ptr %8, align 4
  br label %124

120:                                              ; preds = %90
  %121 = landingpad { ptr, i32 }
          cleanup
  %122 = extractvalue { ptr, i32 } %121, 0
  store ptr %122, ptr %7, align 8
  %123 = extractvalue { ptr, i32 } %121, 1
  store i32 %123, ptr %8, align 4
  call void @_ZN7mjolnir11IgnoreGroupINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEED2Ev(ptr noundef nonnull align 8 dereferenceable(72) %15) #6
  br label %124

124:                                              ; preds = %120, %116
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEESt6vectorIS5_SaIS5_EESt4lessIS5_ESaISt4pairIKS5_S8_EEED2Ev(ptr noundef nonnull align 8 dereferenceable(48) %16) #6
  call void @llvm.lifetime.end.p0(i64 48, ptr %16) #6
  call void @_ZN7mjolnir14IgnoreMoleculeImED2Ev(ptr noundef nonnull align 8 dereferenceable(8) %12) #6
  br label %125

125:                                              ; preds = %124, %112
  call void @_ZNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEED2Ev(ptr noundef nonnull align 8 dereferenceable(32) %13) #6
  br label %126

126:                                              ; preds = %125, %108
  call void @_ZNSt15__new_allocatorIcED2Ev(ptr noundef nonnull align 1 dereferenceable(1) %14) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr %14) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr %13) #6
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessIS5_ESaISt4pairIKS5_mEEED2Ev(ptr noundef nonnull align 8 dereferenceable(48) %11) #6
  call void @llvm.lifetime.end.p0(i64 48, ptr %11) #6
  br label %280

127:                                              ; preds = %103
  call void @llvm.lifetime.start.p0(i64 8, ptr %23) #6
  store i64 0, ptr %23, align 8, !tbaa !11
  br label %128

128:                                              ; preds = %145, %127
  %129 = load i64, ptr %23, align 8, !tbaa !11
  %130 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %5) #6
  %131 = icmp ult i64 %129, %130
  br i1 %131, label %133, label %132

132:                                              ; preds = %128
  store i32 8, ptr %22, align 4
  call void @llvm.lifetime.end.p0(i64 8, ptr %23) #6
  br label %152

133:                                              ; preds = %128
  call void @llvm.lifetime.start.p0(i64 8, ptr %24) #6
  call void @llvm.lifetime.start.p0(i64 16, ptr %25) #6
  %134 = load i64, ptr %21, align 8, !tbaa !11
  %135 = load i64, ptr %23, align 8, !tbaa !11
  %136 = call { double, double } @_ZNK7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_21LennardJonesPotentialIdEEE14prepare_paramsEmm(ptr noundef nonnull align 8 dereferenceable(384) %10, i64 noundef %134, i64 noundef %135) #6
  %137 = getelementptr inbounds { double, double }, ptr %25, i32 0, i32 0
  %138 = extractvalue { double, double } %136, 0
  store double %138, ptr %137, align 8
  %139 = getelementptr inbounds { double, double }, ptr %25, i32 0, i32 1
  %140 = extractvalue { double, double } %136, 1
  store double %140, ptr %139, align 8
  %141 = call noundef double @_ZNK7mjolnir21LennardJonesPotentialIdE15absolute_cutoffERKNS1_14parameter_typeE(ptr noundef nonnull align 8 dereferenceable(16) %3, ptr noundef nonnull align 8 dereferenceable(16) %25) #6
  store double %141, ptr %24, align 8, !tbaa !9
  %142 = invoke noundef nonnull align 8 dereferenceable(8) ptr @_ZSt3maxIdERKT_S2_S2_(ptr noundef nonnull align 8 dereferenceable(8) %20, ptr noundef nonnull align 8 dereferenceable(8) %24)
          to label %143 unwind label %148

143:                                              ; preds = %133
  %144 = load double, ptr %142, align 8, !tbaa !9
  store double %144, ptr %20, align 8, !tbaa !9
  call void @llvm.lifetime.end.p0(i64 16, ptr %25) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %24) #6
  br label %145

145:                                              ; preds = %143
  %146 = load i64, ptr %23, align 8, !tbaa !11
  %147 = add i64 %146, 1
  store i64 %147, ptr %23, align 8, !tbaa !11
  br label %128, !llvm.loop !20

148:                                              ; preds = %133
  %149 = landingpad { ptr, i32 }
          cleanup
  %150 = extractvalue { ptr, i32 } %149, 0
  store ptr %150, ptr %7, align 8
  %151 = extractvalue { ptr, i32 } %149, 1
  store i32 %151, ptr %8, align 4
  call void @llvm.lifetime.end.p0(i64 16, ptr %25) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %24) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %23) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %21) #6
  br label %279

152:                                              ; preds = %132
  br label %153

153:                                              ; preds = %152
  %154 = load i64, ptr %21, align 8, !tbaa !11
  %155 = add i64 %154, 1
  store i64 %155, ptr %21, align 8, !tbaa !11
  br label %103, !llvm.loop !21

156:                                              ; preds = %107
  br label %157

157:                                              ; preds = %174, %156
  %158 = 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) %26, ptr noundef @.str.401, i64 noundef 94)
          to label %159 unwind label %183

159:                                              ; preds = %157
  invoke void @_ZN5boost9unit_test13basic_cstringIKcEC2Ev(ptr noundef nonnull align 8 dereferenceable(16) %27)
          to label %160 unwind label %183

160:                                              ; preds = %159
  invoke void @_ZN5boost9unit_test15unit_test_log_t14set_checkpointENS0_13basic_cstringIKcEEmS4_(ptr noundef nonnull align 8 dereferenceable(8) %158, ptr noundef %26, i64 noundef 95, ptr noundef %27)
          to label %161 unwind label %183

161:                                              ; preds = %160
  call void @llvm.lifetime.start.p0(i64 24, ptr %28) #6
  call void @llvm.lifetime.start.p0(i64 16, ptr %29) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr %30) #6
  call void @llvm.lifetime.start.p0(i64 1, ptr %31) #6
  invoke void @_ZNK5boost10test_tools9assertion4seedpmIRdEENS1_10value_exprIT_EEOS6_(ptr dead_on_unwind writable sret(%"class.boost::test_tools::assertion::value_expr") align 8 %30, ptr noundef nonnull align 1 dereferenceable(1) %31, ptr noundef nonnull align 8 dereferenceable(8) %20)
          to label %162 unwind label %187

162:                                              ; preds = %161
  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") align 8 %29, ptr noundef nonnull align 1 dereferenceable(1) %30, ptr noundef nonnull align 8 dereferenceable(8) %17)
          to label %163 unwind label %187

163:                                              ; preds = %162
  invoke void @_ZNK5boost10test_tools9assertion11binary_exprINS1_10value_exprIRdEERKdNS1_2op2LEIddvEEE8evaluateEb(ptr dead_on_unwind writable sret(%"class.boost::test_tools::assertion_result") align 8 %28, ptr noundef nonnull align 8 dereferenceable(16) %29, i1 noundef zeroext false)
          to label %164 unwind label %187

164:                                              ; preds = %163
  call void @llvm.lifetime.start.p0(i64 32, ptr %32) #6
  %165 = invoke noundef nonnull align 8 dereferenceable(9) ptr @_ZN5boost9unit_test12lazy_ostream8instanceEv()
          to label %166 unwind label %191

166:                                              ; preds = %164
  call void @llvm.lifetime.start.p0(i64 16, ptr %33) #6
  invoke void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %33, ptr noundef @.str.407, i64 noundef 28)
          to label %167 unwind label %195

167:                                              ; preds = %166
  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.351") align 8 %32, ptr noundef nonnull align 8 dereferenceable(9) %165, ptr noundef nonnull align 8 dereferenceable(16) %33)
          to label %168 unwind label %195

168:                                              ; preds = %167
  invoke void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %34, ptr noundef @.str.401, i64 noundef 94)
          to label %169 unwind label %199

169:                                              ; preds = %168
  %170 = 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) %28, ptr noundef nonnull align 8 dereferenceable(9) %32, ptr noundef %34, i64 noundef 95, i32 noundef 1, i32 noundef 14, i64 noundef 0)
          to label %171 unwind label %199

171:                                              ; preds = %169
  call void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(32) %32) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %33) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr %32) #6
  call void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24) %28) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr %31) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %30) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %29) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr %28) #6
  br label %172

172:                                              ; preds = %171
  %173 = invoke noundef zeroext i1 @_ZN5boost10test_tools9tt_detail10dummy_condEv()
          to label %174 unwind label %183

174:                                              ; preds = %172
  br i1 %173, label %157, label %175, !llvm.loop !22

175:                                              ; preds = %174
  call void @llvm.lifetime.start.p0(i64 8, ptr %35) #6
  %176 = call noundef double @_ZNSt14numeric_limitsIdE7epsilonEv() #6
  %177 = fadd double 1.000000e+00, %176
  store double %177, ptr %35, align 8, !tbaa !9
  call void @llvm.lifetime.start.p0(i64 8, ptr %36) #6
  store i64 0, ptr %36, align 8, !tbaa !11
  br label %178

178:                                              ; preds = %275, %175
  %179 = load i64, ptr %36, align 8, !tbaa !11
  %180 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %5) #6
  %181 = icmp ult i64 %179, %180
  br i1 %181, label %206, label %182

182:                                              ; preds = %178
  store i32 13, ptr %22, align 4
  call void @llvm.lifetime.end.p0(i64 8, ptr %36) #6
  br label %278

183:                                              ; preds = %172, %160, %159, %157
  %184 = landingpad { ptr, i32 }
          cleanup
  %185 = extractvalue { ptr, i32 } %184, 0
  store ptr %185, ptr %7, align 8
  %186 = extractvalue { ptr, i32 } %184, 1
  store i32 %186, ptr %8, align 4
  br label %279

187:                                              ; preds = %163, %162, %161
  %188 = landingpad { ptr, i32 }
          cleanup
  %189 = extractvalue { ptr, i32 } %188, 0
  store ptr %189, ptr %7, align 8
  %190 = extractvalue { ptr, i32 } %188, 1
  store i32 %190, ptr %8, align 4
  br label %205

191:                                              ; preds = %164
  %192 = landingpad { ptr, i32 }
          cleanup
  %193 = extractvalue { ptr, i32 } %192, 0
  store ptr %193, ptr %7, align 8
  %194 = extractvalue { ptr, i32 } %192, 1
  store i32 %194, ptr %8, align 4
  br label %204

195:                                              ; preds = %167, %166
  %196 = landingpad { ptr, i32 }
          cleanup
  %197 = extractvalue { ptr, i32 } %196, 0
  store ptr %197, ptr %7, align 8
  %198 = extractvalue { ptr, i32 } %196, 1
  store i32 %198, ptr %8, align 4
  br label %203

199:                                              ; preds = %169, %168
  %200 = landingpad { ptr, i32 }
          cleanup
  %201 = extractvalue { ptr, i32 } %200, 0
  store ptr %201, ptr %7, align 8
  %202 = extractvalue { ptr, i32 } %200, 1
  store i32 %202, ptr %8, align 4
  call void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(32) %32) #6
  br label %203

203:                                              ; preds = %199, %195
  call void @llvm.lifetime.end.p0(i64 16, ptr %33) #6
  br label %204

204:                                              ; preds = %203, %191
  call void @llvm.lifetime.end.p0(i64 32, ptr %32) #6
  call void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24) %28) #6
  br label %205

205:                                              ; preds = %204, %187
  call void @llvm.lifetime.end.p0(i64 1, ptr %31) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %30) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %29) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr %28) #6
  br label %279

206:                                              ; preds = %178
  call void @llvm.lifetime.start.p0(i64 8, ptr %37) #6
  store i64 0, ptr %37, align 8, !tbaa !11
  br label %207

207:                                              ; preds = %242, %206
  %208 = load i64, ptr %37, align 8, !tbaa !11
  %209 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %5) #6
  %210 = icmp ult i64 %208, %209
  br i1 %210, label %212, label %211

211:                                              ; preds = %207
  store i32 16, ptr %22, align 4
  call void @llvm.lifetime.end.p0(i64 8, ptr %37) #6
  br label %274

212:                                              ; preds = %207
  br label %213

213:                                              ; preds = %240, %212
  %214 = 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) %38, ptr noundef @.str.401, i64 noundef 94)
          to label %215 unwind label %245

215:                                              ; preds = %213
  invoke void @_ZN5boost9unit_test13basic_cstringIKcEC2Ev(ptr noundef nonnull align 8 dereferenceable(16) %39)
          to label %216 unwind label %245

216:                                              ; preds = %215
  invoke void @_ZN5boost9unit_test15unit_test_log_t14set_checkpointENS0_13basic_cstringIKcEEmS4_(ptr noundef nonnull align 8 dereferenceable(8) %214, ptr noundef %38, i64 noundef 102, ptr noundef %39)
          to label %217 unwind label %245

217:                                              ; preds = %216
  call void @llvm.lifetime.start.p0(i64 24, ptr %40) #6
  call void @llvm.lifetime.start.p0(i64 16, ptr %41) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr %42) #6
  call void @llvm.lifetime.start.p0(i64 1, ptr %43) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr %44) #6
  %218 = load double, ptr %20, align 8, !tbaa !9
  %219 = fmul double %218, 0x3FF0000000000001
  call void @llvm.lifetime.start.p0(i64 16, ptr %45) #6
  %220 = load i64, ptr %36, align 8, !tbaa !11
  %221 = load i64, ptr %37, align 8, !tbaa !11
  %222 = call { double, double } @_ZNK7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_21LennardJonesPotentialIdEEE14prepare_paramsEmm(ptr noundef nonnull align 8 dereferenceable(384) %10, i64 noundef %220, i64 noundef %221) #6
  %223 = getelementptr inbounds { double, double }, ptr %45, i32 0, i32 0
  %224 = extractvalue { double, double } %222, 0
  store double %224, ptr %223, align 8
  %225 = getelementptr inbounds { double, double }, ptr %45, i32 0, i32 1
  %226 = extractvalue { double, double } %222, 1
  store double %226, ptr %225, align 8
  %227 = call noundef double @_ZNK7mjolnir21LennardJonesPotentialIdE9potentialEdRKNS1_14parameter_typeE(ptr noundef nonnull align 8 dereferenceable(16) %3, double noundef %219, ptr noundef nonnull align 8 dereferenceable(16) %45) #6
  store double %227, ptr %44, align 8, !tbaa !9
  invoke void @_ZNK5boost10test_tools9assertion4seedpmIdEENS1_10value_exprIT_EEOS5_(ptr dead_on_unwind writable sret(%"class.boost::test_tools::assertion::value_expr.354") align 8 %42, ptr noundef nonnull align 1 dereferenceable(1) %43, ptr noundef nonnull align 8 dereferenceable(8) %44)
          to label %228 unwind label %249

228:                                              ; preds = %217
  call void @llvm.lifetime.start.p0(i64 8, ptr %46) #6
  store double 0.000000e+00, ptr %46, align 8, !tbaa !9
  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.352") align 8 %41, ptr noundef nonnull align 1 dereferenceable(1) %42, ptr noundef nonnull align 8 dereferenceable(8) %46)
          to label %229 unwind label %253

229:                                              ; preds = %228
  invoke void @_ZNK5boost10test_tools9assertion11binary_exprINS1_10value_exprIdEEdNS1_2op2EQIddvEEE8evaluateEb(ptr dead_on_unwind writable sret(%"class.boost::test_tools::assertion_result") align 8 %40, ptr noundef nonnull align 8 dereferenceable(16) %41, i1 noundef zeroext false)
          to label %230 unwind label %253

230:                                              ; preds = %229
  call void @llvm.lifetime.start.p0(i64 32, ptr %47) #6
  %231 = invoke noundef nonnull align 8 dereferenceable(9) ptr @_ZN5boost9unit_test12lazy_ostream8instanceEv()
          to label %232 unwind label %257

232:                                              ; preds = %230
  call void @llvm.lifetime.start.p0(i64 16, ptr %48) #6
  invoke void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %48, ptr noundef @.str.408, i64 noundef 88)
          to label %233 unwind label %261

233:                                              ; preds = %232
  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.351") align 8 %47, ptr noundef nonnull align 8 dereferenceable(9) %231, ptr noundef nonnull align 8 dereferenceable(16) %48)
          to label %234 unwind label %261

234:                                              ; preds = %233
  invoke void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %49, ptr noundef @.str.401, i64 noundef 94)
          to label %235 unwind label %265

235:                                              ; preds = %234
  %236 = 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) %40, ptr noundef nonnull align 8 dereferenceable(9) %47, ptr noundef %49, i64 noundef 102, i32 noundef 1, i32 noundef 14, i64 noundef 0)
          to label %237 unwind label %265

237:                                              ; preds = %235
  call void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(32) %47) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %48) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr %47) #6
  call void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24) %40) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %46) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %45) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %44) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr %43) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %42) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %41) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr %40) #6
  br label %238

238:                                              ; preds = %237
  %239 = invoke noundef zeroext i1 @_ZN5boost10test_tools9tt_detail10dummy_condEv()
          to label %240 unwind label %245

240:                                              ; preds = %238
  br i1 %239, label %213, label %241, !llvm.loop !23

241:                                              ; preds = %240
  br label %242

242:                                              ; preds = %241
  %243 = load i64, ptr %37, align 8, !tbaa !11
  %244 = add i64 %243, 1
  store i64 %244, ptr %37, align 8, !tbaa !11
  br label %207, !llvm.loop !24

245:                                              ; preds = %238, %216, %215, %213
  %246 = landingpad { ptr, i32 }
          cleanup
  %247 = extractvalue { ptr, i32 } %246, 0
  store ptr %247, ptr %7, align 8
  %248 = extractvalue { ptr, i32 } %246, 1
  store i32 %248, ptr %8, align 4
  br label %273

249:                                              ; preds = %217
  %250 = landingpad { ptr, i32 }
          cleanup
  %251 = extractvalue { ptr, i32 } %250, 0
  store ptr %251, ptr %7, align 8
  %252 = extractvalue { ptr, i32 } %250, 1
  store i32 %252, ptr %8, align 4
  br label %272

253:                                              ; preds = %229, %228
  %254 = landingpad { ptr, i32 }
          cleanup
  %255 = extractvalue { ptr, i32 } %254, 0
  store ptr %255, ptr %7, align 8
  %256 = extractvalue { ptr, i32 } %254, 1
  store i32 %256, ptr %8, align 4
  br label %271

257:                                              ; preds = %230
  %258 = landingpad { ptr, i32 }
          cleanup
  %259 = extractvalue { ptr, i32 } %258, 0
  store ptr %259, ptr %7, align 8
  %260 = extractvalue { ptr, i32 } %258, 1
  store i32 %260, ptr %8, align 4
  br label %270

261:                                              ; preds = %233, %232
  %262 = landingpad { ptr, i32 }
          cleanup
  %263 = extractvalue { ptr, i32 } %262, 0
  store ptr %263, ptr %7, align 8
  %264 = extractvalue { ptr, i32 } %262, 1
  store i32 %264, ptr %8, align 4
  br label %269

265:                                              ; preds = %235, %234
  %266 = landingpad { ptr, i32 }
          cleanup
  %267 = extractvalue { ptr, i32 } %266, 0
  store ptr %267, ptr %7, align 8
  %268 = extractvalue { ptr, i32 } %266, 1
  store i32 %268, ptr %8, align 4
  call void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(32) %47) #6
  br label %269

269:                                              ; preds = %265, %261
  call void @llvm.lifetime.end.p0(i64 16, ptr %48) #6
  br label %270

270:                                              ; preds = %269, %257
  call void @llvm.lifetime.end.p0(i64 32, ptr %47) #6
  call void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24) %40) #6
  br label %271

271:                                              ; preds = %270, %253
  call void @llvm.lifetime.end.p0(i64 8, ptr %46) #6
  br label %272

272:                                              ; preds = %271, %249
  call void @llvm.lifetime.end.p0(i64 16, ptr %45) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %44) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr %43) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %42) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %41) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr %40) #6
  br label %273

273:                                              ; preds = %272, %245
  call void @llvm.lifetime.end.p0(i64 8, ptr %37) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %36) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %35) #6
  br label %279

274:                                              ; preds = %211
  br label %275

275:                                              ; preds = %274
  %276 = load i64, ptr %36, align 8, !tbaa !11
  %277 = add i64 %276, 1
  store i64 %277, ptr %36, align 8, !tbaa !11
  br label %178, !llvm.loop !25

278:                                              ; preds = %182
  call void @llvm.lifetime.end.p0(i64 8, ptr %35) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %20) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %17) #6
  call void @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_21LennardJonesPotentialIdEEED2Ev(ptr noundef nonnull align 8 dereferenceable(384) %10) #6
  call void @llvm.lifetime.end.p0(i64 384, ptr %10) #6
  call void @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EED2Ev(ptr noundef nonnull align 8 dereferenceable(24) %5) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr %5) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %3) #6
  ret void

279:                                              ; preds = %273, %205, %183, %148
  call void @llvm.lifetime.end.p0(i64 8, ptr %20) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr %17) #6
  call void @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_21LennardJonesPotentialIdEEED2Ev(ptr noundef nonnull align 8 dereferenceable(384) %10) #6
  br label %280

280:                                              ; preds = %279, %126
  call void @llvm.lifetime.end.p0(i64 384, ptr %10) #6
  br label %281

281:                                              ; preds = %280, %83
  call void @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EED2Ev(ptr noundef nonnull align 8 dereferenceable(24) %5) #6
  br label %282

282:                                              ; preds = %281, %57
  call void @llvm.lifetime.end.p0(i64 24, ptr %5) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr %3) #6
  br label %283

283:                                              ; preds = %282
  %284 = load ptr, ptr %7, align 8
  %285 = load i32, ptr %8, align 4
  %286 = insertvalue { ptr, i32 } poison, ptr %284, 0
  %287 = insertvalue { ptr, i32 } %286, i32 %285, 1
  resume { ptr, i32 } %287
}

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSaISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEEEC2Ev(ptr noundef nonnull align 1 dereferenceable(1)) unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_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 @_ZNKSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_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 @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_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_21LennardJonesPotentialIdEEEC2ERKSt6vectorISt4pairImNS5_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 @_ZNK7mjolnir21LennardJonesPotentialIdE10max_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_21LennardJonesPotentialIdEEE10parametersEv(ptr noundef nonnull align 8 dereferenceable(384)) #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local ptr @_ZNSt6vectorIN7mjolnir21LennardJonesPotentialIdE14parameter_typeESaIS3_EE5beginEv(ptr noundef nonnull align 8 dereferenceable(24)) #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local ptr @_ZNSt6vectorIN7mjolnir21LennardJonesPotentialIdE14parameter_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 @_ZNK7mjolnir21LennardJonesPotentialIdE15absolute_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_21LennardJonesPotentialIdEEE14prepare_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") 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") 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: 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.351") 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 nounwind uwtable
declare dso_local noundef double @_ZNSt14numeric_limitsIdE7epsilonEv() #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.354") 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 @_ZNK7mjolnir21LennardJonesPotentialIdE9potentialEdRKNS1_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.352") 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_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_21LennardJonesPotentialIdEEED2Ev(ptr noundef nonnull align 8 dereferenceable(384)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_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_allocatorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_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 = !{!"double", !7, i64 0}
!11 = !{!12, !12, i64 0}
!12 = !{!"long", !7, i64 0}
!13 = !{!14, !12, i64 0}
!14 = !{!"_ZTSSt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEE", !12, i64 0, !15, i64 8}
!15 = !{!"_ZTSN7mjolnir21LennardJonesPotentialIdE14parameter_typeE", !10, i64 0, !10, i64 8}
!16 = !{!14, !10, i64 16}
!17 = !{!14, !10, i64 8}
!18 = distinct !{!18, !19}
!19 = !{!"llvm.loop.mustprogress"}
!20 = distinct !{!20, !19}
!21 = distinct !{!21, !19}
!22 = distinct !{!22, !19}
!23 = distinct !{!23, !19}
!24 = distinct !{!24, !19}
!25 = distinct !{!25, !19}


; 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.mjolnir::LennardJonesPotential" = type { double, double }
%"class.std::vector.315" = type { %"struct.std::_Vector_base.316" }
%"struct.std::_Vector_base.316" = type { %"struct.std::_Vector_base<std::pair<unsigned long, mjolnir::LennardJonesPotential<double>::parameter_type>, std::allocator<std::pair<unsigned long, mjolnir::LennardJonesPotential<double>::parameter_type>>>::_Vector_impl" }
%"struct.std::_Vector_base<std::pair<unsigned long, mjolnir::LennardJonesPotential<double>::parameter_type>, std::allocator<std::pair<unsigned long, mjolnir::LennardJonesPotential<double>::parameter_type>>>::_Vector_impl" = type { %"struct.std::_Vector_base<std::pair<unsigned long, mjolnir::LennardJonesPotential<double>::parameter_type>, std::allocator<std::pair<unsigned long, mjolnir::LennardJonesPotential<double>::parameter_type>>>::_Vector_impl_data" }
%"struct.std::_Vector_base<std::pair<unsigned long, mjolnir::LennardJonesPotential<double>::parameter_type>, std::allocator<std::pair<unsigned long, mjolnir::LennardJonesPotential<double>::parameter_type>>>::_Vector_impl_data" = type { ptr, ptr, ptr }
%"class.std::allocator.317" = type { i8 }
%"class.mjolnir::LorentzBerthelotRule" = type { %"struct.mjolnir::ParameterListBase", double, %"class.std::vector.7", %"class.std::vector.322", %"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.322" = type { %"struct.std::_Vector_base.323" }
%"struct.std::_Vector_base.323" = type { %"struct.std::_Vector_base<mjolnir::LennardJonesPotential<double>::parameter_type, std::allocator<mjolnir::LennardJonesPotential<double>::parameter_type>>::_Vector_impl" }
%"struct.std::_Vector_base<mjolnir::LennardJonesPotential<double>::parameter_type, std::allocator<mjolnir::LennardJonesPotential<double>::parameter_type>>::_Vector_impl" = type { %"struct.std::_Vector_base<mjolnir::LennardJonesPotential<double>::parameter_type, std::allocator<mjolnir::LennardJonesPotential<double>::parameter_type>>::_Vector_impl_data" }
%"struct.std::_Vector_base<mjolnir::LennardJonesPotential<double>::parameter_type, std::allocator<mjolnir::LennardJonesPotential<double>::parameter_type>>::_Vector_impl_data" = type { ptr, ptr, ptr }
%"class.mjolnir::ExclusionList" = type { %"class.mjolnir::IgnoreMolecule", %"class.mjolnir::IgnoreGroup", %"class.std::vector.334", %"class.std::vector.7", %"class.std::vector", %"class.std::vector.7", %"class.std::vector.7", %"class.std::vector.339", %"class.std::vector.7", %"class.std::vector.339", %"class.std::vector.7", %"class.std::vector.339" }
%"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.328" }
%"struct.std::_Head_base.328" = type { ptr }
%"class.mjolnir::IgnoreGroup" = type { %"class.std::map.329", %"class.std::vector" }
%"class.std::map.329" = type { %"class.std::_Rb_tree.330" }
%"class.std::_Rb_tree.330" = 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.334" = type { %"struct.std::_Vector_base.335" }
%"struct.std::_Vector_base.335" = 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.339" = type { %"struct.std::_Vector_base.340" }
%"struct.std::_Vector_base.340" = 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.344" = type { %"class.std::_Rb_tree.345" }
%"class.std::_Rb_tree.345" = 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::LennardJonesPotential<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" = type { %"class.boost::test_tools::assertion::value_expr", ptr }
%"class.boost::test_tools::assertion::value_expr" = type { ptr }
%"class.boost::test_tools::assertion::seed" = type { i8 }
%"class.boost::unit_test::lazy_ostream_impl.351" = type { %"class.boost::unit_test::lazy_ostream.base", ptr, ptr }
%"class.boost::unit_test::lazy_ostream.base" = type <{ ptr, i8 }>
%"class.boost::test_tools::assertion::binary_expr.352" = type { %"class.boost::test_tools::assertion::value_expr.354", double }
%"class.boost::test_tools::assertion::value_expr.354" = type { double }

@_ZN5boost9unit_test12_GLOBAL__N_113unit_test_logE = external hidden local_unnamed_addr global ptr, align 8
@.str.401 = external hidden unnamed_addr constant [95 x i8], align 1
@.str.406 = external hidden unnamed_addr constant [8 x i8], align 1
@.str.407 = external hidden unnamed_addr constant [29 x i8], align 1
@.str.408 = 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 @_ZN7mjolnir21LennardJonesPotentialIdEC2ERKd(ptr noundef nonnull align 8 dereferenceable(16), ptr noundef nonnull align 8 dereferenceable(8)) unnamed_addr #1 align 2

; 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::LennardJonesPotential", align 8
  %3 = alloca double, align 8
  %4 = alloca %"class.std::vector.315", align 8
  %5 = alloca %"class.std::allocator.317", align 1
  %6 = alloca %"class.mjolnir::LorentzBerthelotRule", align 8
  %7 = alloca %"class.std::map.344", align 8
  %8 = alloca %"class.mjolnir::IgnoreMolecule", align 8
  %9 = alloca %"class.std::__cxx11::basic_string", align 8
  %10 = alloca %"class.std::allocator", align 1
  %11 = alloca %"class.mjolnir::IgnoreGroup", align 8
  %12 = alloca %"class.std::map.329", align 8
  %13 = alloca double, align 8
  %14 = alloca double, align 8
  %15 = alloca double, align 8
  %16 = alloca %"struct.mjolnir::LennardJonesPotential<double>::parameter_type", align 8
  %17 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %18 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %19 = alloca %"class.boost::test_tools::assertion_result", align 8
  %20 = alloca %"class.boost::test_tools::assertion::binary_expr", align 8
  %21 = alloca %"class.boost::test_tools::assertion::value_expr", align 8
  %22 = alloca %"class.boost::test_tools::assertion::seed", align 1
  %23 = alloca %"class.boost::unit_test::lazy_ostream_impl.351", 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::unit_test::basic_cstring", align 8
  %28 = alloca %"class.boost::test_tools::assertion_result", align 8
  %29 = alloca %"class.boost::test_tools::assertion::binary_expr.352", align 8
  %30 = alloca %"class.boost::test_tools::assertion::value_expr.354", align 8
  %31 = alloca %"class.boost::test_tools::assertion::seed", align 1
  %32 = alloca double, align 8
  %33 = alloca %"struct.mjolnir::LennardJonesPotential<double>::parameter_type", align 8
  %34 = alloca double, align 8
  %35 = alloca %"class.boost::unit_test::lazy_ostream_impl.351", align 8
  %36 = alloca %"class.boost::unit_test::basic_cstring", align 8
  %37 = alloca %"class.boost::unit_test::basic_cstring", align 8
  call void @llvm.lifetime.start.p0(i64 16, ptr nonnull %2) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr nonnull %3) #6
  store double 2.500000e+00, ptr %3, align 8, !tbaa !5
  call void @_ZN7mjolnir21LennardJonesPotentialIdEC2ERKd(ptr noundef nonnull align 8 dereferenceable(16) %2, ptr noundef nonnull align 8 dereferenceable(8) %3) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %3) #6
  call void @llvm.lifetime.start.p0(i64 24, ptr nonnull %4) #6
  call void @llvm.lifetime.start.p0(i64 1, ptr nonnull %5) #6
  call void @_ZNSaISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEEEC2Ev(ptr noundef nonnull align 1 dereferenceable(1) %5) #6
  invoke void @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EEC2EmRKS6_(ptr noundef nonnull align 8 dereferenceable(24) %4, i64 noundef 10, ptr noundef nonnull align 1 dereferenceable(1) %5)
          to label %38 unwind label %40

38:                                               ; preds = %1
  call void @_ZNSt15__new_allocatorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEEED2Ev(ptr noundef nonnull align 1 dereferenceable(1) %5) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr nonnull %5) #6
  %39 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  %.not = icmp eq i64 %39, 0
  br i1 %.not, label %._crit_edge, label %.lr.ph

._crit_edge:                                      ; preds = %48, %38
  call void @llvm.lifetime.start.p0(i64 384, ptr nonnull %6) #6
  call void @llvm.lifetime.start.p0(i64 48, ptr nonnull %7) #6
  call void @llvm.memset.p0.i64(ptr noundef nonnull align 8 dereferenceable(48) %7, i8 0, i64 48, i1 false)
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessIS5_ESaISt4pairIKS5_mEEEC2Ev(ptr noundef nonnull align 8 dereferenceable(48) %7) #6
  call void @llvm.lifetime.start.p0(i64 32, ptr nonnull %9) #6
  call void @llvm.lifetime.start.p0(i64 1, ptr nonnull %10) #6
  call void @_ZNSaIcEC2Ev(ptr noundef nonnull align 1 dereferenceable(1) %10) #6
  invoke void @_ZNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEC2IS3_EEPKcRKS3_(ptr noundef nonnull align 8 dereferenceable(32) %9, ptr noundef nonnull @.str.406, ptr noundef nonnull align 1 dereferenceable(1) %10)
          to label %57 unwind label %69

40:                                               ; preds = %1
  %41 = landingpad { ptr, i32 }
          cleanup
  call void @_ZNSt15__new_allocatorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEEED2Ev(ptr noundef nonnull align 1 dereferenceable(1) %5) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr nonnull %5) #6
  br label %157

.lr.ph:                                           ; preds = %38, %48
  %.03959 = phi i64 [ %52, %48 ], [ 0, %38 ]
  %42 = invoke noundef nonnull align 8 dereferenceable(24) ptr @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE2atEm(ptr noundef nonnull align 8 dereferenceable(24) %4, i64 noundef %.03959)
          to label %43 unwind label %55

43:                                               ; preds = %.lr.ph
  store i64 %.03959, ptr %42, align 8, !tbaa !9
  %44 = invoke noundef nonnull align 8 dereferenceable(24) ptr @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE2atEm(ptr noundef nonnull align 8 dereferenceable(24) %4, i64 noundef %.03959)
          to label %45 unwind label %55

45:                                               ; preds = %43
  %46 = getelementptr inbounds i8, ptr %44, i64 16
  store double 1.000000e+00, ptr %46, align 8, !tbaa !13
  %47 = invoke noundef nonnull align 8 dereferenceable(24) ptr @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE2atEm(ptr noundef nonnull align 8 dereferenceable(24) %4, i64 noundef %.03959)
          to label %48 unwind label %55

48:                                               ; preds = %45
  %49 = uitofp i64 %.03959 to double
  %50 = fadd double %49, 1.000000e+00
  %51 = getelementptr inbounds i8, ptr %47, i64 8
  store double %50, ptr %51, align 8, !tbaa !14
  %52 = add nuw i64 %.03959, 1
  %53 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  %54 = icmp ult i64 %52, %53
  br i1 %54, label %.lr.ph, label %._crit_edge, !llvm.loop !15

55:                                               ; preds = %45, %43, %.lr.ph
  %56 = landingpad { ptr, i32 }
          cleanup
  br label %156

57:                                               ; preds = %._crit_edge
  invoke void @_ZN7mjolnir14IgnoreMoleculeImEC2ERKNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE(ptr noundef nonnull align 8 dereferenceable(8) %8, ptr noundef nonnull align 8 dereferenceable(32) %9)
          to label %58 unwind label %71

58:                                               ; preds = %57
  call void @llvm.lifetime.start.p0(i64 48, ptr nonnull %12) #6
  call void @llvm.memset.p0.i64(ptr noundef nonnull align 8 dereferenceable(48) %12, i8 0, i64 48, i1 false)
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEESt6vectorIS5_SaIS5_EESt4lessIS5_ESaISt4pairIKS5_S8_EEEC2Ev(ptr noundef nonnull align 8 dereferenceable(48) %12) #6
  invoke void @_ZN7mjolnir11IgnoreGroupINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEEC2ERKSt3mapIS6_St6vectorIS6_SaIS6_EESt4lessIS6_ESaISt4pairIKS6_SB_EEE(ptr noundef nonnull align 8 dereferenceable(72) %11, ptr noundef nonnull align 8 dereferenceable(48) %12)
          to label %59 unwind label %73

59:                                               ; preds = %58
  invoke void @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_21LennardJonesPotentialIdEEEC2ERKSt6vectorISt4pairImNS5_14parameter_typeEESaISA_EERKSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessISL_ESaIS8_IKSL_mEEENS_14IgnoreMoleculeImEENS_11IgnoreGroupISL_EE(ptr noundef nonnull align 8 dereferenceable(384) %6, ptr noundef nonnull align 8 dereferenceable(24) %4, ptr noundef nonnull align 8 dereferenceable(48) %7, ptr noundef nonnull %8, ptr noundef nonnull %11)
          to label %60 unwind label %75

60:                                               ; preds = %59
  call void @_ZN7mjolnir11IgnoreGroupINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEED2Ev(ptr noundef nonnull align 8 dereferenceable(72) %11) #6
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEESt6vectorIS5_SaIS5_EESt4lessIS5_ESaISt4pairIKS5_S8_EEED2Ev(ptr noundef nonnull align 8 dereferenceable(48) %12) #6
  call void @llvm.lifetime.end.p0(i64 48, ptr nonnull %12) #6
  call void @_ZN7mjolnir14IgnoreMoleculeImED2Ev(ptr noundef nonnull align 8 dereferenceable(8) %8) #6
  call void @_ZNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEED2Ev(ptr noundef nonnull align 8 dereferenceable(32) %9) #6
  call void @_ZNSt15__new_allocatorIcED2Ev(ptr noundef nonnull align 1 dereferenceable(1) %10) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr nonnull %10) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr nonnull %9) #6
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessIS5_ESaISt4pairIKS5_mEEED2Ev(ptr noundef nonnull align 8 dereferenceable(48) %7) #6
  call void @llvm.lifetime.end.p0(i64 48, ptr nonnull %7) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr nonnull %13) #6
  %61 = call noundef nonnull align 8 dereferenceable(24) ptr @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_21LennardJonesPotentialIdEEE10parametersEv(ptr noundef nonnull align 8 dereferenceable(384) %6) #6
  %62 = call ptr @_ZNSt6vectorIN7mjolnir21LennardJonesPotentialIdE14parameter_typeESaIS3_EE5beginEv(ptr noundef nonnull align 8 dereferenceable(24) %61) #6
  %63 = call noundef nonnull align 8 dereferenceable(24) ptr @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_21LennardJonesPotentialIdEEE10parametersEv(ptr noundef nonnull align 8 dereferenceable(384) %6) #6
  %64 = call ptr @_ZNSt6vectorIN7mjolnir21LennardJonesPotentialIdE14parameter_typeESaIS3_EE3endEv(ptr noundef nonnull align 8 dereferenceable(24) %63) #6
  %65 = call noundef double @_ZNK7mjolnir21LennardJonesPotentialIdE10max_cutoffIN9__gnu_cxx17__normal_iteratorIPNS1_14parameter_typeESt6vectorIS5_SaIS5_EEEEEEdT_SB_(ptr noundef nonnull align 8 dereferenceable(16) %2, ptr %62, ptr %64) #6
  store double %65, ptr %13, align 8, !tbaa !5
  call void @llvm.lifetime.start.p0(i64 8, ptr nonnull %14) #6
  store double 0.000000e+00, ptr %14, align 8, !tbaa !5
  %66 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  %.not68 = icmp eq i64 %66, 0
  br i1 %.not68, label %.preheader57.preheader, label %.preheader58.lr.ph

.preheader57.preheader:                           ; preds = %._crit_edge62, %60
  br label %.preheader57

.preheader58.lr.ph:                               ; preds = %60
  %67 = getelementptr inbounds i8, ptr %16, i64 8
  br label %.preheader58

.preheader58:                                     ; preds = %.preheader58.lr.ph, %._crit_edge62
  %.02563 = phi i64 [ 0, %.preheader58.lr.ph ], [ %80, %._crit_edge62 ]
  %68 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  %.not69 = icmp eq i64 %68, 0
  br i1 %.not69, label %._crit_edge62, label %.lr.ph61

69:                                               ; preds = %._crit_edge
  %70 = landingpad { ptr, i32 }
          cleanup
  br label %79

71:                                               ; preds = %57
  %72 = landingpad { ptr, i32 }
          cleanup
  br label %78

73:                                               ; preds = %58
  %74 = landingpad { ptr, i32 }
          cleanup
  br label %77

75:                                               ; preds = %59
  %76 = landingpad { ptr, i32 }
          cleanup
  call void @_ZN7mjolnir11IgnoreGroupINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEED2Ev(ptr noundef nonnull align 8 dereferenceable(72) %11) #6
  br label %77

77:                                               ; preds = %75, %73
  %.pn = phi { ptr, i32 } [ %76, %75 ], [ %74, %73 ]
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEESt6vectorIS5_SaIS5_EESt4lessIS5_ESaISt4pairIKS5_S8_EEED2Ev(ptr noundef nonnull align 8 dereferenceable(48) %12) #6
  call void @llvm.lifetime.end.p0(i64 48, ptr nonnull %12) #6
  call void @_ZN7mjolnir14IgnoreMoleculeImED2Ev(ptr noundef nonnull align 8 dereferenceable(8) %8) #6
  br label %78

78:                                               ; preds = %77, %71
  %.pn.pn = phi { ptr, i32 } [ %.pn, %77 ], [ %72, %71 ]
  call void @_ZNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEED2Ev(ptr noundef nonnull align 8 dereferenceable(32) %9) #6
  br label %79

79:                                               ; preds = %78, %69
  %.pn.pn.pn = phi { ptr, i32 } [ %.pn.pn, %78 ], [ %70, %69 ]
  call void @_ZNSt15__new_allocatorIcED2Ev(ptr noundef nonnull align 1 dereferenceable(1) %10) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr nonnull %10) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr nonnull %9) #6
  call void @_ZNSt3mapINSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEEmSt4lessIS5_ESaISt4pairIKS5_mEEED2Ev(ptr noundef nonnull align 8 dereferenceable(48) %7) #6
  call void @llvm.lifetime.end.p0(i64 48, ptr nonnull %7) #6
  br label %155

._crit_edge62:                                    ; preds = %.lr.ph61, %.preheader58
  %80 = add nuw i64 %.02563, 1
  %81 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  %82 = icmp ult i64 %80, %81
  br i1 %82, label %.preheader58, label %.preheader57.preheader, !llvm.loop !17

.lr.ph61:                                         ; preds = %.preheader58, %.lr.ph61
  %.02460 = phi i64 [ %89, %.lr.ph61 ], [ 0, %.preheader58 ]
  call void @llvm.lifetime.start.p0(i64 8, ptr nonnull %15) #6
  call void @llvm.lifetime.start.p0(i64 16, ptr nonnull %16) #6
  %83 = call { double, double } @_ZNK7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_21LennardJonesPotentialIdEEE14prepare_paramsEmm(ptr noundef nonnull align 8 dereferenceable(384) %6, i64 noundef %.02563, i64 noundef %.02460) #6
  %84 = extractvalue { double, double } %83, 0
  store double %84, ptr %16, align 8
  %85 = extractvalue { double, double } %83, 1
  store double %85, ptr %67, align 8
  %86 = call noundef double @_ZNK7mjolnir21LennardJonesPotentialIdE15absolute_cutoffERKNS1_14parameter_typeE(ptr noundef nonnull align 8 dereferenceable(16) %2, ptr noundef nonnull align 8 dereferenceable(16) %16) #6
  store double %86, ptr %15, align 8, !tbaa !5
  %87 = call noundef nonnull align 8 dereferenceable(8) ptr @_ZSt3maxIdERKT_S2_S2_(ptr noundef nonnull align 8 dereferenceable(8) %14, ptr noundef nonnull align 8 dereferenceable(8) %15)
  %88 = load double, ptr %87, align 8, !tbaa !5
  store double %88, ptr %14, align 8, !tbaa !5
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %16) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %15) #6
  %89 = add nuw i64 %.02460, 1
  %90 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  %91 = icmp ult i64 %89, %90
  br i1 %91, label %.lr.ph61, label %._crit_edge62, !llvm.loop !18

.preheader57:                                     ; preds = %.preheader57.preheader, %100
  %92 = 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) %17, ptr noundef nonnull @.str.401, i64 noundef 94)
  call void @_ZN5boost9unit_test13basic_cstringIKcEC2Ev(ptr noundef nonnull align 8 dereferenceable(16) %18)
  invoke void @_ZN5boost9unit_test15unit_test_log_t14set_checkpointENS0_13basic_cstringIKcEEmS4_(ptr noundef nonnull align 8 dereferenceable(8) %92, ptr noundef nonnull %17, i64 noundef 95, ptr noundef nonnull %18)
          to label %93 unwind label %107

93:                                               ; preds = %.preheader57
  call void @llvm.lifetime.start.p0(i64 24, ptr nonnull %19) #6
  call void @llvm.lifetime.start.p0(i64 16, ptr nonnull %20) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr nonnull %21) #6
  call void @llvm.lifetime.start.p0(i64 1, ptr nonnull %22) #6
  invoke void @_ZNK5boost10test_tools9assertion4seedpmIRdEENS1_10value_exprIT_EEOS6_(ptr dead_on_unwind nonnull writable sret(%"class.boost::test_tools::assertion::value_expr") align 8 %21, ptr noundef nonnull align 1 dereferenceable(1) %22, ptr noundef nonnull align 8 dereferenceable(8) %14)
          to label %94 unwind label %109

94:                                               ; preds = %93
  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") align 8 %20, ptr noundef nonnull align 1 dereferenceable(1) %21, ptr noundef nonnull align 8 dereferenceable(8) %13)
          to label %95 unwind label %109

95:                                               ; preds = %94
  invoke void @_ZNK5boost10test_tools9assertion11binary_exprINS1_10value_exprIRdEERKdNS1_2op2LEIddvEEE8evaluateEb(ptr dead_on_unwind nonnull writable sret(%"class.boost::test_tools::assertion_result") align 8 %19, ptr noundef nonnull align 8 dereferenceable(16) %20, i1 noundef zeroext false)
          to label %96 unwind label %109

96:                                               ; preds = %95
  call void @llvm.lifetime.start.p0(i64 32, ptr nonnull %23) #6
  %97 = call noundef nonnull align 8 dereferenceable(9) ptr @_ZN5boost9unit_test12lazy_ostream8instanceEv()
  call void @llvm.lifetime.start.p0(i64 16, ptr nonnull %24) #6
  call void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %24, ptr noundef nonnull @.str.407, 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.351") align 8 %23, ptr noundef nonnull align 8 dereferenceable(9) %97, ptr noundef nonnull align 8 dereferenceable(16) %24)
          to label %98 unwind label %111

98:                                               ; preds = %96
  call void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %25, ptr noundef nonnull @.str.401, i64 noundef 94)
  %99 = 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) %19, ptr noundef nonnull align 8 dereferenceable(9) %23, ptr noundef nonnull %25, i64 noundef 95, i32 noundef 1, i32 noundef 14, i64 noundef 0)
          to label %100 unwind label %113

100:                                              ; preds = %98
  call void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(32) %23) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %24) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr nonnull %23) #6
  call void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24) %19) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr nonnull %22) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %21) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %20) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr nonnull %19) #6
  %101 = call noundef zeroext i1 @_ZN5boost10test_tools9tt_detail10dummy_condEv()
  br i1 %101, label %.preheader57, label %102, !llvm.loop !21

102:                                              ; preds = %100
  %103 = call noundef double @_ZNSt14numeric_limitsIdE7epsilonEv() #6
  %104 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  %.not70 = icmp eq i64 %104, 0
  br i1 %.not70, label %._crit_edge67, label %.preheader56.lr.ph

.preheader56.lr.ph:                               ; preds = %102
  %105 = getelementptr inbounds i8, ptr %33, i64 8
  br label %.preheader56

.preheader56:                                     ; preds = %.preheader56.lr.ph, %._crit_edge65
  %.02266 = phi i64 [ 0, %.preheader56.lr.ph ], [ %117, %._crit_edge65 ]
  %106 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  %.not71 = icmp eq i64 %106, 0
  br i1 %.not71, label %._crit_edge65, label %.preheader

._crit_edge67:                                    ; preds = %._crit_edge65, %102
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %14) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %13) #6
  call void @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_21LennardJonesPotentialIdEEED2Ev(ptr noundef nonnull align 8 dereferenceable(384) %6) #6
  call void @llvm.lifetime.end.p0(i64 384, ptr nonnull %6) #6
  call void @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EED2Ev(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr nonnull %4) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %2) #6
  ret void

107:                                              ; preds = %.preheader57
  %108 = landingpad { ptr, i32 }
          cleanup
  br label %154

109:                                              ; preds = %95, %94, %93
  %110 = landingpad { ptr, i32 }
          cleanup
  br label %116

111:                                              ; preds = %96
  %112 = landingpad { ptr, i32 }
          cleanup
  br label %115

113:                                              ; preds = %98
  %114 = landingpad { ptr, i32 }
          cleanup
  call void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(32) %23) #6
  br label %115

115:                                              ; preds = %113, %111
  %.pn43 = phi { ptr, i32 } [ %114, %113 ], [ %112, %111 ]
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %24) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr nonnull %23) #6
  call void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24) %19) #6
  br label %116

116:                                              ; preds = %115, %109
  %.pn43.pn = phi { ptr, i32 } [ %.pn43, %115 ], [ %110, %109 ]
  call void @llvm.lifetime.end.p0(i64 1, ptr nonnull %22) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %21) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %20) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr nonnull %19) #6
  br label %154

.preheader:                                       ; preds = %.preheader56, %137
  %.064 = phi i64 [ %138, %137 ], [ 0, %.preheader56 ]
  br label %120

._crit_edge65:                                    ; preds = %137, %.preheader56
  %117 = add nuw i64 %.02266, 1
  %118 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  %119 = icmp ult i64 %117, %118
  br i1 %119, label %.preheader56, label %._crit_edge67, !llvm.loop !22

120:                                              ; preds = %.preheader, %135
  %121 = 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) %26, ptr noundef nonnull @.str.401, i64 noundef 94)
  call void @_ZN5boost9unit_test13basic_cstringIKcEC2Ev(ptr noundef nonnull align 8 dereferenceable(16) %27)
  invoke void @_ZN5boost9unit_test15unit_test_log_t14set_checkpointENS0_13basic_cstringIKcEEmS4_(ptr noundef nonnull align 8 dereferenceable(8) %121, ptr noundef nonnull %26, i64 noundef 102, ptr noundef nonnull %27)
          to label %122 unwind label %141

122:                                              ; preds = %120
  call void @llvm.lifetime.start.p0(i64 24, ptr nonnull %28) #6
  call void @llvm.lifetime.start.p0(i64 16, ptr nonnull %29) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr nonnull %30) #6
  call void @llvm.lifetime.start.p0(i64 1, ptr nonnull %31) #6
  call void @llvm.lifetime.start.p0(i64 8, ptr nonnull %32) #6
  %123 = load double, ptr %14, align 8, !tbaa !5
  %124 = fmul double %123, 0x3FF0000000000001
  call void @llvm.lifetime.start.p0(i64 16, ptr nonnull %33) #6
  %125 = call { double, double } @_ZNK7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_21LennardJonesPotentialIdEEE14prepare_paramsEmm(ptr noundef nonnull align 8 dereferenceable(384) %6, i64 noundef %.02266, i64 noundef %.064) #6
  %126 = extractvalue { double, double } %125, 0
  store double %126, ptr %33, align 8
  %127 = extractvalue { double, double } %125, 1
  store double %127, ptr %105, align 8
  %128 = call noundef double @_ZNK7mjolnir21LennardJonesPotentialIdE9potentialEdRKNS1_14parameter_typeE(ptr noundef nonnull align 8 dereferenceable(16) %2, double noundef %124, ptr noundef nonnull align 8 dereferenceable(16) %33) #6
  store double %128, ptr %32, align 8, !tbaa !5
  invoke void @_ZNK5boost10test_tools9assertion4seedpmIdEENS1_10value_exprIT_EEOS5_(ptr dead_on_unwind nonnull writable sret(%"class.boost::test_tools::assertion::value_expr.354") align 8 %30, ptr noundef nonnull align 1 dereferenceable(1) %31, ptr noundef nonnull align 8 dereferenceable(8) %32)
          to label %129 unwind label %143

129:                                              ; preds = %122
  call void @llvm.lifetime.start.p0(i64 8, ptr nonnull %34) #6
  store double 0.000000e+00, ptr %34, align 8, !tbaa !5
  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.352") align 8 %29, ptr noundef nonnull align 1 dereferenceable(1) %30, ptr noundef nonnull align 8 dereferenceable(8) %34)
          to label %130 unwind label %145

130:                                              ; preds = %129
  invoke void @_ZNK5boost10test_tools9assertion11binary_exprINS1_10value_exprIdEEdNS1_2op2EQIddvEEE8evaluateEb(ptr dead_on_unwind nonnull writable sret(%"class.boost::test_tools::assertion_result") align 8 %28, ptr noundef nonnull align 8 dereferenceable(16) %29, i1 noundef zeroext false)
          to label %131 unwind label %145

131:                                              ; preds = %130
  call void @llvm.lifetime.start.p0(i64 32, ptr nonnull %35) #6
  %132 = call noundef nonnull align 8 dereferenceable(9) ptr @_ZN5boost9unit_test12lazy_ostream8instanceEv()
  call void @llvm.lifetime.start.p0(i64 16, ptr nonnull %36) #6
  call void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %36, ptr noundef nonnull @.str.408, 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.351") align 8 %35, ptr noundef nonnull align 8 dereferenceable(9) %132, ptr noundef nonnull align 8 dereferenceable(16) %36)
          to label %133 unwind label %147

133:                                              ; preds = %131
  call void @_ZN5boost9unit_test13basic_cstringIKcEC2ImEEPS2_T_(ptr noundef nonnull align 8 dereferenceable(16) %37, ptr noundef nonnull @.str.401, i64 noundef 94)
  %134 = 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) %28, ptr noundef nonnull align 8 dereferenceable(9) %35, ptr noundef nonnull %37, i64 noundef 102, i32 noundef 1, i32 noundef 14, i64 noundef 0)
          to label %135 unwind label %149

135:                                              ; preds = %133
  call void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(32) %35) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %36) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr nonnull %35) #6
  call void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24) %28) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %34) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %33) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %32) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr nonnull %31) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %30) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %29) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr nonnull %28) #6
  %136 = call noundef zeroext i1 @_ZN5boost10test_tools9tt_detail10dummy_condEv()
  br i1 %136, label %120, label %137, !llvm.loop !23

137:                                              ; preds = %135
  %138 = add nuw i64 %.064, 1
  %139 = call noundef i64 @_ZNKSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EE4sizeEv(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  %140 = icmp ult i64 %138, %139
  br i1 %140, label %.preheader, label %._crit_edge65, !llvm.loop !24

141:                                              ; preds = %120
  %142 = landingpad { ptr, i32 }
          cleanup
  br label %154

143:                                              ; preds = %122
  %144 = landingpad { ptr, i32 }
          cleanup
  br label %153

145:                                              ; preds = %130, %129
  %146 = landingpad { ptr, i32 }
          cleanup
  br label %152

147:                                              ; preds = %131
  %148 = landingpad { ptr, i32 }
          cleanup
  br label %151

149:                                              ; preds = %133
  %150 = landingpad { ptr, i32 }
          cleanup
  call void @_ZN5boost9unit_test12lazy_ostreamD2Ev(ptr noundef nonnull align 8 dereferenceable(32) %35) #6
  br label %151

151:                                              ; preds = %149, %147
  %.pn46 = phi { ptr, i32 } [ %150, %149 ], [ %148, %147 ]
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %36) #6
  call void @llvm.lifetime.end.p0(i64 32, ptr nonnull %35) #6
  call void @_ZN5boost10test_tools16assertion_resultD2Ev(ptr noundef nonnull align 8 dereferenceable(24) %28) #6
  br label %152

152:                                              ; preds = %151, %145
  %.pn46.pn = phi { ptr, i32 } [ %.pn46, %151 ], [ %146, %145 ]
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %34) #6
  br label %153

153:                                              ; preds = %152, %143
  %.pn46.pn.pn = phi { ptr, i32 } [ %.pn46.pn, %152 ], [ %144, %143 ]
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %33) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %32) #6
  call void @llvm.lifetime.end.p0(i64 1, ptr nonnull %31) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %30) #6
  call void @llvm.lifetime.end.p0(i64 16, ptr nonnull %29) #6
  call void @llvm.lifetime.end.p0(i64 24, ptr nonnull %28) #6
  br label %154

154:                                              ; preds = %141, %153, %116, %107
  %.pn46.pn.pn.pn.pn = phi { ptr, i32 } [ %.pn43.pn, %116 ], [ %108, %107 ], [ %.pn46.pn.pn, %153 ], [ %142, %141 ]
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %14) #6
  call void @llvm.lifetime.end.p0(i64 8, ptr nonnull %13) #6
  call void @_ZN7mjolnir20LorentzBerthelotRuleINS_15SimulatorTraitsIdNS_17UnlimitedBoundaryEEENS_21LennardJonesPotentialIdEEED2Ev(ptr noundef nonnull align 8 dereferenceable(384) %6) #6
  br label %155

155:                                              ; preds = %154, %79
  %.pn46.pn.pn.pn.pn.pn = phi { ptr, i32 } [ %.pn46.pn.pn.pn.pn, %154 ], [ %.pn.pn.pn, %79 ]
  call void @llvm.lifetime.end.p0(i64 384, ptr nonnull %6) #6
  br label %156

156:                                              ; preds = %155, %55
  %.pn53 = phi { ptr, i32 } [ %56, %55 ], [ %.pn46.pn.pn.pn.pn.pn, %155 ]
  call void @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEESaIS5_EED2Ev(ptr noundef nonnull align 8 dereferenceable(24) %4) #6
  br label %157

157:                                              ; preds = %156, %40
  %.pn53.pn = phi { ptr, i32 } [ %.pn53, %156 ], [ %41, %40 ]
  call void @llvm.lifetime.end.p0(i64 24, ptr nonnull %4) #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 @_ZNSaISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEEEC2Ev(ptr noundef nonnull align 1 dereferenceable(1)) unnamed_addr #1 align 2

; Function Attrs: mustprogress uwtable
declare dso_local void @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_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 @_ZNKSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_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 @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_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_21LennardJonesPotentialIdEEEC2ERKSt6vectorISt4pairImNS5_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 @_ZNK7mjolnir21LennardJonesPotentialIdE10max_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_21LennardJonesPotentialIdEEE10parametersEv(ptr noundef nonnull align 8 dereferenceable(384)) local_unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local ptr @_ZNSt6vectorIN7mjolnir21LennardJonesPotentialIdE14parameter_typeESaIS3_EE5beginEv(ptr noundef nonnull align 8 dereferenceable(24)) local_unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local ptr @_ZNSt6vectorIN7mjolnir21LennardJonesPotentialIdE14parameter_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 @_ZNK7mjolnir21LennardJonesPotentialIdE15absolute_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_21LennardJonesPotentialIdEEE14prepare_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") 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") 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: 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.351") 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 nounwind uwtable
declare dso_local noundef double @_ZNSt14numeric_limitsIdE7epsilonEv() local_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.354") 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 @_ZNK7mjolnir21LennardJonesPotentialIdE9potentialEdRKNS1_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.352") 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_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_21LennardJonesPotentialIdEEED2Ev(ptr noundef nonnull align 8 dereferenceable(384)) unnamed_addr #1 align 2

; Function Attrs: mustprogress nounwind uwtable
declare dso_local void @_ZNSt6vectorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_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_allocatorISt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_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, !6, i64 0}
!6 = !{!"double", !7, i64 0}
!7 = !{!"omnipotent char", !8, i64 0}
!8 = !{!"Simple C++ TBAA"}
!9 = !{!10, !11, i64 0}
!10 = !{!"_ZTSSt4pairImN7mjolnir21LennardJonesPotentialIdE14parameter_typeEE", !11, i64 0, !12, i64 8}
!11 = !{!"long", !7, i64 0}
!12 = !{!"_ZTSN7mjolnir21LennardJonesPotentialIdE14parameter_typeE", !6, i64 0, !6, i64 8}
!13 = !{!10, !6, i64 16}
!14 = !{!10, !6, i64 8}
!15 = distinct !{!15, !16}
!16 = !{!"llvm.loop.mustprogress"}
!17 = distinct !{!17, !16}
!18 = distinct !{!18, !16}
!19 = !{!20, !20, i64 0}
!20 = !{!"any pointer", !7, i64 0}
!21 = distinct !{!21, !16}
!22 = distinct !{!22, !16}
!23 = distinct !{!23, !16}
!24 = distinct !{!24, !16}


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