Backend/COD_ICSD_XYZs_POMs_unique99/4078271_0_1.1rscale.xyz

190

In  2.09099 1.85742 -1.63605
In  -2.09099 -1.85742 1.63605
In  2.37925 -1.47367 -1.75914
In  -2.37925 1.47367 1.75914
O   0.702715 1.88746 0.116075
O   -0.702715 -1.88746 -0.116075
O   3.10489 0.252093 -0.713303
O   -3.10489 -0.252093 0.713303
O   -0.105599 1.93218 -1.88344
O   0.105599 -1.93218 1.88344
O   2.11747 0.250272 -3.01669
O   -2.11747 -0.250272 3.01669
O   1.51268 -1.92853 0.15667
O   -1.51268 1.92853 -0.15667
O   0.331884 -2.02322 -2.44586
O   -0.331884 2.02322 2.44586
C   -0.338741 1.91599 -0.621492
C   0.338741 -1.91599 0.621492
C   1.65256 -1.88362 -6.28685
C   -1.65256 1.88362 6.28685
H   1.72799 -1.13503 -6.83403
H   -1.72799 1.13503 6.83403
C   2.69621 -2.18022 -5.41605
C   -2.69621 2.18022 5.41605
C   3.76318 -3.01338 -2.36532
C   -3.76318 3.01338 2.36532
C   3.94009 -1.34139 -5.43299
C   -3.94009 1.34139 5.43299
H   4.5586 -1.67118 -4.77771
H   -4.5586 1.67118 4.77771
H   3.7138 -0.430946 -5.22956
H   -3.7138 0.430946 5.22956
H   4.34329 -1.38388 -6.30282
H   -4.34329 1.38388 6.30282
C   1.43039 -4.09297 -4.65808
C   -1.43039 4.09297 4.65808
C   2.56867 -3.28551 -4.58448
C   -2.56867 3.28551 4.58448
C   3.65895 -3.62804 -3.61915
C   -3.65895 3.62804 3.61915
C   4.77665 -3.40346 -1.48374
C   -4.77665 3.40346 1.48374
C   2.22033 3.61711 -4.3996
C   -2.22033 -3.61711 4.3996
C   3.73163 3.85363 0.382716
C   -3.73163 -3.85363 -0.382716
C   3.03769 3.74296 -2.04182
C   -3.03769 -3.74296 2.04182
C   0.499197 -2.66256 -6.37014
C   -0.499197 2.66256 6.37014
C   4.93985 -2.82644 -0.126596
C   -4.93985 2.82644 0.126596
C   2.98284 4.30339 -3.30954
C   -2.98284 -4.30339 3.30954
C   4.7314 2.96604 0.77161
C   -4.7314 -2.96604 -0.77161
C   0.418283 -3.76117 -5.53638
C   -0.418283 3.76117 5.53638
H   -0.342855 -4.29327 -5.56767
H   0.342855 4.29327 5.56767
C   0.843423 3.84007 -4.52359
C   -0.843423 -3.84007 4.52359
C   3.7138 4.40657 -1.00191
C   -3.7138 -4.40657 1.00191
C   5.70511 -4.37825 -1.89301
C   -5.70511 4.37825 1.89301
H   6.3963 -4.62103 -1.32027
H   -6.3963 4.62103 1.32027
C   4.57917 -4.60687 -4.01041
C   -4.57917 4.60687 4.01041
H   4.51334 -5.00949 -4.84634
H   -4.51334 5.00949 4.84634
C   2.71953 4.23258 1.26672
C   -2.71953 -4.23258 -1.26672
C   5.77231 -1.72378 0.0544805
C   -5.77231 1.72378 -0.0544805
C   5.60911 -4.97307 -3.11963
C   -5.60911 4.97307 3.11963
H   6.22625 -5.62253 -3.36858
H   -6.22625 5.62253 3.36858
C   4.3186 -3.4415 0.962568
C   -4.3186 3.4415 -0.962568
C   2.87998 2.77383 -5.28386
C   -2.87998 -2.77383 5.28386
C   3.64798 5.49911 -3.56057
C   -3.64798 -5.49911 3.56057
H   3.62192 5.86936 -4.4145
H   -3.62192 -5.86936 4.4145
C   0.776224 2.31861 -6.40888
C   -0.776224 -2.31861 6.40888
C   4.35426 5.62051 -1.28181
C   -4.35426 -5.62051 1.28181
H   4.789 6.07978 -0.600403
H   -4.789 -6.07978 0.600403
C   1.28091 -5.30084 -3.75458
C   -1.28091 5.30084 3.75458
H   2.06673 -5.39188 -3.21002
H   -2.06673 5.39188 3.21002
H   1.16708 -6.08787 -4.28874
H   -1.16708 6.08787 4.28874
H   0.512911 -5.18349 -3.18969
H   -0.512911 5.18349 3.18969
C   2.14353 2.12843 -6.28335
C   -2.14353 -2.12843 6.28335
H   2.57964 1.5599 -6.87469
H   -2.57964 -1.5599 6.87469
C   4.34466 6.14047 -2.56571
C   -4.34466 -6.14047 2.56571
H   4.80957 6.92346 -2.75268
H   -4.80957 -6.92346 2.75268
C   4.69163 2.46024 2.0562
C   -4.69163 -2.46024 -2.0562
H   5.35402 1.86136 2.31693
H   -5.35402 -1.86136 -2.31693
C   3.39289 -4.60687 0.780911
C   -3.39289 4.60687 -0.780911
H   3.32158 -4.81729 -0.152962
H   -3.32158 4.81729 0.152962
H   2.52478 -4.38432 1.12337
H   -2.52478 4.38432 -1.12337
H   3.73712 -5.3676 1.25343
H   -3.73712 5.3676 -1.25343
C   0.156342 3.16634 -5.54073
C   -0.156342 -3.16634 5.54073
H   -0.759767 3.30392 -5.62781
H   0.759767 -3.30392 5.62781
C   6.4155 -1.0541 -1.06892
C   -6.4155 1.0541 1.06892
H   6.94898 -0.323715 -0.745124
H   -6.94898 0.323715 0.745124
H   5.74488 -0.720266 -1.66975
H   -5.74488 0.720266 1.66975
H   6.97778 -1.67927 -1.53574
H   -6.97778 1.67927 1.53574
C   -0.614396 -2.32063 -7.3422
C   0.614396 2.32063 7.3422
H   -0.381255 -1.52753 -7.83081
H   0.381255 1.52753 7.83081
H   -1.42765 -2.16687 -6.85538
H   1.42765 2.16687 6.85538
H   -0.740567 -3.04899 -7.95489
H   0.740567 3.04899 7.95489
C   3.71518 2.80216 2.97457
C   -3.71518 -2.80216 -2.97457
C   4.35151 2.54723 -5.16921
C   -4.35151 -2.54723 5.16921
H   4.6354 1.94027 -5.8569
H   -4.6354 -1.94027 5.8569
H   4.55174 2.17294 -4.30782
H   -4.55174 -2.17294 4.30782
H   4.81231 3.38282 -5.27178
H   -4.81231 -3.38282 5.27178
C   5.82168 2.55533 -0.147886
C   -5.82168 -2.55533 0.147886
H   5.70785 2.99234 -0.994934
H   -5.70785 -2.99234 0.994934
H   5.79699 1.60441 -0.270996
H   -5.79699 -1.60441 0.270996
H   6.66921 2.80823 0.229472
H   -6.66921 -2.80823 -0.229472
C   1.6265 5.1754 0.882901
C   -1.6265 -5.1754 -0.882901
H   1.03954 5.30488 1.63185
H   -1.03954 -5.30488 -1.63185
H   1.13142 4.80919 0.147679
H   -1.13142 -4.80919 -0.147679
H   2.00776 6.01706 0.625944
H   -2.00776 -6.01706 -0.625944
C   2.74558 3.68428 2.56358
C   -2.74558 -3.68428 -2.56358
H   2.08044 3.92909 3.16708
H   -2.08044 -3.92909 -3.16708
C   0.0219427 1.60846 -7.49435
C   -0.0219427 -1.60846 7.49435
H   0.626739 1.06219 -8.00088
H   -0.626739 -1.06219 8.00088
H   -0.388112 2.25387 -8.07338
H   0.388112 -2.25387 8.07338
H   -0.65691 1.0541 -7.10082
H   0.65691 -1.0541 7.10082
C   5.99996 -1.27463 1.35842
C   -5.99996 1.27463 -1.35842
H   6.5595 -0.546269 1.49949
H   -6.5595 0.546269 -1.49949
C   4.57094 -2.95997 2.24449
C   -4.57094 2.95997 -2.24449
H   4.165 -3.36461 2.9777
H   -4.165 3.36461 -2.9777
C   5.40888 -1.89373 2.44056
C   -5.40888 1.89373 -2.44056