Backend/COD_ICSD_XYZs_POMs_unique99/4117761_0_1.0rscale.xyz

105

Mn  -3.44273 -1.06538 2.58364
Mn  -3.46752 0.582601 -0.0935146
Li  -1.38792 -1.30562 0.539546
O   -2.22986 0.45155 1.89883
O   -1.7135 -2.00625 2.76054
C   -2.53602 3.05955 2.98972
H   -3.15405 2.70888 2.31317
H   -2.45262 4.03031 2.88413
H   -2.87987 2.85669 3.8829
C   -0.59739 2.80743 1.42018
H   0.215988 2.30557 1.20375
H   -0.39633 3.7682 1.43032
H   -1.28511 2.62449 0.746899
C   -0.239823 2.81207 3.89467
H   -0.605386 2.49479 4.74536
H   -0.188416 3.78969 3.90463
H   0.656948 2.43893 3.76527
C   -1.10232 2.38571 2.80699
C   -1.39135 0.859457 2.72454
C   -0.687638 -0.0296567 3.52721
H   -0.0513301 0.336784 4.12981
C   -0.844145 -1.41845 3.52065
O   -1.2931 -0.144457 -0.749426
O   0.00236202 -2.46131 0.207338
C   -0.64537 2.20033 -2.22179
H   0.124597 2.43252 -1.65681
H   -1.46103 2.21665 -1.68316
H   -0.718483 2.85092 -2.94914
C   -1.67009 0.580735 -3.63653
H   -1.57756 -0.316361 -4.02435
H   -1.73064 1.24252 -4.35619
H   -2.48232 0.618294 -3.08952
C   0.750624 0.877409 -3.70322
H   0.850011 -0.0149534 -4.10005
H   1.55943 1.1018 -3.19529
H   0.616965 1.53653 -4.41603
C   -0.455734 0.886336 -2.76668
C   -0.410039 -0.19289 -1.6544
C   0.564415 -1.15746 -1.697
H   1.20187 -1.06273 -2.39582
C   0.757478 -2.28406 -0.841855
C   1.76963 -3.35287 -1.16852
C   0.942544 -4.54082 -1.80496
H   0.190855 -4.76667 -1.2178
H   1.52288 -5.32445 -1.90391
H   0.603256 -4.27103 -2.68331
C   2.85033 -2.93944 -2.13956
H   2.45392 -2.77771 -3.02048
H   3.51862 -3.65414 -2.20788
H   3.27986 -2.11856 -1.81921
C   2.38652 -3.85574 0.150683
H   2.87203 -3.12332 0.58429
H   3.00455 -4.59257 -0.0372105
H   1.67367 -4.17057 0.746954
O   0.0789018 -2.00693 -0.424755
O   -1.20057 -1.81375 2.17487
C   -0.245535 -2.62055 2.4323
C   0.674084 -3.13399 1.53296
H   1.30697 -3.75924 1.86576
C   0.749481 -2.79683 0.135994
C   1.81304 -3.5054 -0.751584
C   1.10248 -4.32401 -1.74452
H   0.475309 -4.9214 -1.28449
H   1.74793 -4.85499 -2.25303
H   0.605541 -3.73829 -2.35424
C   2.67326 -2.41666 -1.4543
H   2.09064 -1.82781 -1.97742
H   3.32213 -2.84709 -2.04921
H   3.14849 -1.88958 -0.779983
C   2.80806 -4.38402 0.0347355
H   3.2216 -3.85235 0.747108
H   3.50377 -4.71351 -0.571968
H   2.33168 -5.14537 0.429674
O   -2.33039 0.715043 1.62269
O   -1.73977 0.450166 -0.957479
C   -0.619095 1.37328 3.90617
H   -0.44888 1.81809 4.76363
H   0.227412 1.05353 3.53307
H   -1.22342 0.614821 4.04553
C   -0.254674 3.61429 2.8494
H   -0.609956 4.34063 2.2949
H   0.591832 3.29832 2.46662
H   -0.100453 3.9417 3.75828
C   -2.59885 2.89595 3.38646
H   -3.01011 3.4842 2.71742
H   -2.46747 3.3882 4.2215
H   -3.18718 2.12841 3.54811
C   -1.29653 2.41521 2.88221
C   -1.40734 1.70872 1.61099
C   -0.735618 2.08766 0.474426
H   -0.108449 2.79833 0.540667
C   -0.932108 1.47303 -0.790157
C   -0.145006 1.94928 -2.03167
C   -1.24969 2.21785 -3.14276
H   -1.78204 3.00252 -2.89068
H   -1.83573 1.43552 -3.21818
H   -0.8133 2.38266 -4.0047
C   0.68665 3.17752 -1.81164
H   0.123455 3.89557 -1.45846
H   1.07963 3.46087 -2.66588
H   1.40293 2.97551 -1.17459
C   0.687793 0.823318 -2.50004
H   0.98824 0.997456 -3.41743
H   0.161153 -0.0035804 -2.48129
H   1.46804 0.728425 -1.91345