Backend/COD_ICSD_XYZs_POMs_unique99/4100879_0_1.0rscale.xyz

58

Cu  -0.620412 -1.02942 -0.704135
Cu  0.575024 0.852541 0.727182
O   0.137057 -0.303706 2.25271
C   -0.612436 -1.31895 2.14565
C   -1.0253 -2.00261 3.41221
C   -0.417732 -1.65394 4.61988
H   0.260213 -1.01643 4.63872
C   -0.834117 -2.2624 5.79055
H   -0.434153 -2.03167 6.59742
C   -1.82406 -3.19731 5.7733
H   -2.10087 -3.59555 6.56795
C   -2.40817 -3.55111 4.59472
H   -3.07439 -4.20059 4.58352
C   -2.01407 -2.94607 3.41022
H   -2.42459 -3.18364 2.60926
O   -1.01592 -1.80315 1.06469
O   2.18028 -0.190901 0.363212
C   2.18614 -1.29673 -0.220081
C   3.49277 -2.0009 -0.359183
C   4.6692 -1.29673 -0.228055
H   4.65865 -0.375491 -0.0943687
C   5.88552 -1.99577 -0.29958
H   6.68897 -1.5343 -0.228693
C   5.89256 -3.33576 -0.468712
H   6.70187 -3.7921 -0.492433
C   4.72668 -4.02626 -0.604017
H   4.7431 -4.94578 -0.732156
C   3.53969 -3.36994 -0.551382
H   2.7468 -3.8485 -0.64544
O   1.16336 -1.8693 -0.689048
O   0.819694 1.72336 -0.997845
C   0.548751 1.18839 -2.10748
C   0.994459 1.92504 -3.31777
C   2.0149 2.86679 -3.19707
H   2.40313 3.02745 -2.36676
C   2.45357 3.56754 -4.32111
H   3.14793 4.18113 -4.24564
C   1.8589 3.34877 -5.53523
H   2.1533 3.81366 -6.28562
C   0.843153 2.45659 -5.64838
H   0.434978 2.33011 -6.47579
C   0.402136 1.7319 -4.55142
H   -0.289884 1.11832 -4.64471
O   -0.0459176 0.0835897 -2.24425
O   -1.24229 1.64132 0.832637
C   -2.21933 1.17814 0.180377
C   -3.5025 1.94726 0.222517
C   -3.55997 3.21204 0.807422
H   -2.79641 3.5778 1.19148
C   -4.73172 3.91792 0.820256
H   -4.754 4.75541 1.22432
C   -5.84833 3.42568 0.262544
H   -6.64005 3.91279 0.285637
C   -5.8108 2.18141 -0.352271
H   -6.5732 1.84813 -0.767681
C   -4.65665 1.44135 -0.348936
H   -4.64961 0.595312 -0.733918
O   -2.19587 0.125293 -0.519239