Backend/COD_ICSD_XYZs_POMs_unique99/4078020_0_1.1rscale.xyz

80

Nd  -1.17014 -1.38133 -0.647455
Nd  1.17014 1.38133 0.647455
Si  -4.47269 -2.22555 -1.29517
Si  4.47269 2.22555 1.29517
Si  -3.52471 -2.7295 1.5383
Si  3.52471 2.7295 -1.5383
O   -0.588375 0.959526 -0.819519
O   0.588375 -0.959526 0.819519
O   -0.851414 -3.65316 -1.73018
O   0.851414 3.65316 1.73018
N   -0.00922942 -1.37319 -2.64563
N   0.00922942 1.37319 2.64563
N   -3.2776 -2.212 -0.0726725
N   3.2776 2.212 0.0726725
C   -1.31981 1.32712 -1.92894
C   1.31981 -1.32712 1.92894
C   -2.49079 2.11671 -1.83568
C   2.49079 -2.11671 1.83568
C   -3.16108 2.39068 -3.01997
C   3.16108 -2.39068 3.01997
H   -3.95134 2.89818 -2.9708
H   3.95134 -2.89818 2.9708
C   -2.73768 1.95992 -4.27923
C   2.73768 -1.95992 4.27923
C   -1.60477 1.17387 -4.31288
C   1.60477 -1.17387 4.31288
H   -1.30366 0.852773 -5.14236
H   1.30366 -0.852773 5.14236
C   -0.891793 0.840472 -3.17435
C   0.891793 -0.840472 3.17435
C   0.294188 -0.0917409 -3.27951
C   -0.294188 0.0917409 3.27951
H   0.515694 -0.237692 -4.22235
H   -0.515694 0.237692 4.22235
H   1.07177 0.314838 -2.84209
H   -1.07177 -0.314838 2.84209
C   0.566456 -2.48534 -3.20621
C   -0.566456 2.48534 3.20621
C   0.0934479 -3.74053 -2.76707
C   -0.0934479 3.74053 2.76707
C   0.518001 -4.94358 -3.29393
C   -0.518001 4.94358 3.29393
H   0.159207 -5.75674 -2.9915
H   -0.159207 5.75674 2.9915
C   1.49055 -4.91439 -4.28047
C   -1.49055 4.91439 4.28047
H   1.78935 -5.71921 -4.66626
H   -1.78935 5.71921 4.66626
C   2.01086 -3.73636 -4.69071
C   -2.01086 3.73636 4.69071
H   2.69038 -3.73844 -5.33887
H   -2.69038 3.73844 5.33887
C   1.56554 -2.52079 -4.1794
C   -1.56554 2.52079 4.1794
H   1.94049 -1.71597 -4.49105
H   -1.94049 1.71597 4.49105
C   -1.36826 -4.89771 -1.22145
C   1.36826 4.89771 1.22145
H   -1.79166 -5.38978 -1.94241
H   1.79166 5.38978 1.94241
H   -2.02124 -4.71632 -0.52719
H   2.02124 4.71632 0.52719
H   -0.641445 -5.42314 -0.853724
H   0.641445 5.42314 0.853724
C   -3.78291 -1.33858 -2.77562
C   3.78291 1.33858 2.77562
H   -3.70792 -0.391984 -2.57788
H   3.70792 0.391984 2.57788
H   -4.3759 -1.46368 -3.53228
H   4.3759 1.46368 3.53228
H   -2.90727 -1.69512 -2.98648
H   2.90727 1.69512 2.98648
C   -4.23053 -1.38445 2.6216
C   4.23053 1.38445 -2.6216
H   -3.61678 -0.633846 2.64693
H   3.61678 0.633846 -2.64693
H   -4.35859 -1.72848 3.51977
H   4.35859 1.72848 -3.51977
H   -5.0831 -1.09464 2.26242
H   5.0831 1.09464 -2.26242