Backend/COD_ICSD_XYZs_POMs_unique99/4081467_0_1.1rscale.xyz

40

C   -1.60907 -1.95468 -0.795846
C   -2.75746 -2.51423 -1.32588
C   -3.61011 -3.23353 -0.488286
C   -3.30553 -3.36854 0.853427
C   -2.16598 -2.7855 1.38844
C   -1.30208 -2.06157 0.567759
C   -0.0492164 -1.4521 1.09854
C   0.222411 -0.0495205 1.14132
C   -0.618991 1.07757 0.80545
C   0.0182886 2.34532 0.515541
C   -1.85337 0.952292 0.140411
C   1.35071 2.76241 0.990154
C   2.81493 4.60368 1.12788
C   1.31294 -3.0716 -0.47059
C   2.80287 -1.04494 0.584166
C   2.47338 -1.09455 -1.90831
C   1.49054 1.42771 -1.76744
C   -0.982233 1.92847 -2.26732
O   1.51899 4.07859 0.759314
O   2.20585 2.08196 1.50578
O   1.20164 -4.19671 -0.490981
O   3.7342 -0.912274 1.21764
O   3.1977 -1.05766 -2.78423
O   2.4778 1.83923 -2.18248
O   -1.54719 2.54174 -3.04179
S   -0.415753 -1.13282 -1.8461
Fe  1.36317 -1.27731 -0.47983
Fe  -0.0808795 0.970732 -1.07663
H   -2.93425 -2.41312 -2.27447
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H   -1.97793 -2.89317 2.32703
H   0.312418 -1.92825 1.82054
H   0.96336 0.178182 1.64685
H   -0.531395 3.04969 0.373838
H   -2.35564 0.158612 0.126643
H   -2.39582 1.76511 -0.0144775
H   3.00458 4.44588 2.00961
H   2.72331 5.60005 1.01624
H   3.4948 4.1527 0.652392