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{
"id": "jvasp-109846",
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{
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"structure_string": "Lu3 Mg2 Cr1 S8\n1.0\n6.620200 -0.000299 3.824167\n2.205939 6.150397 3.822787\n-0.000876 -0.000506 7.645484\nLu Mg Cr S\n3 2 1 8\ndirect\n0.500014 0.499992 0.499993 Lu\n0.500008 0.500000 -0.000000 Lu\n-0.000002 0.500007 0.500013 Lu\n0.874724 0.875857 0.874714 Mg\n0.125283 0.124139 0.125289 Mg\n0.499983 0.000000 0.499996 Cr\n0.731903 0.763823 0.731905 S\n0.268013 0.236256 0.727626 S\n0.255658 0.733157 0.255642 S\n0.727620 0.236242 0.268020 S\n0.744352 0.266840 0.744359 S\n0.272384 0.763728 0.731982 S\n0.268069 0.236214 0.268090 S\n0.731994 0.763737 0.272376 S\n",
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{
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"updated_at": "2022-09-04T14:36:44.373600Z",
"structure_string": "Th1 Pb1 I6\n1.0\n7.338751 0.107199 0.000000\n-6.067850 4.129159 0.000000\n-0.000000 -0.000000 10.058991\nTh Pb I\n1 1 6\ndirect\n0.237195 0.762806 0.500000 Th\n0.764285 0.235715 -0.000000 Pb\n0.143330 0.856671 0.797754 I\n0.853632 0.146369 0.677043 I\n0.143330 0.856671 0.202246 I\n0.853632 0.146369 0.322957 I\n0.427019 0.572982 -0.000000 I\n0.575479 0.424521 0.500000 I\n",
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{
"id": "jvasp-19082",
"created_at": "2022-09-04T14:36:55.097109Z",
"updated_at": "2022-09-04T14:36:55.097124Z",
"structure_string": "Ba3 Ti6 O15\n1.0\n3.916574 0.000000 0.000000\n-1.958287 8.302396 -1.917749\n0.000000 -0.003330 9.577577\nBa Ti O\n3 6 15\ndirect\n0.369246 0.738493 0.016678 Ba\n0.500000 -0.000000 0.500000 Ba\n0.630753 0.261507 0.983322 Ba\n0.038579 0.077158 0.209715 Ti\n0.961420 0.922843 0.790286 Ti\n0.205902 0.411805 0.373319 Ti\n0.794096 0.588195 0.626681 Ti\n0.832975 0.665953 0.304059 Ti\n0.167023 0.334048 0.695941 Ti\n0.847431 0.694865 0.814041 O\n0.152568 0.305135 0.185959 O\n0.892369 0.784741 0.574241 O\n0.000000 0.000000 0.000000 O\n0.534737 0.069475 0.208800 O\n0.675135 0.350272 0.661196 O\n0.324863 0.649728 0.338804 O\n0.734984 0.469970 0.399462 O\n0.265015 0.530031 0.600539 O\n0.788322 0.576647 0.121837 O\n0.211676 0.423354 0.878163 O\n0.941723 0.883449 0.287751 O\n0.058276 0.116552 0.712249 O\n0.465262 0.930526 0.791200 O\n0.107629 0.215260 0.425759 O\n",
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{
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"created_at": "2022-09-04T14:36:54.870233Z",
"updated_at": "2022-09-04T14:36:54.870245Z",
"structure_string": "Li4 Nb4 Cr4 O16\n1.0\n6.133253 0.000079 0.000156\n-0.000072 6.133254 0.000076\n-0.000089 -0.000371 8.278648\nLi Nb Cr O\n4 4 4 16\ndirect\n0.760800 -0.000000 -0.000002 Li\n0.239196 -0.000001 0.500000 Li\n0.000000 0.239198 0.250002 Li\n0.000002 0.760803 0.750002 Li\n0.754892 0.245103 0.625000 Nb\n0.245112 0.245115 0.875001 Nb\n0.754892 0.754893 0.375000 Nb\n0.245106 0.754890 0.125001 Nb\n0.499999 0.751215 0.750000 Cr\n0.248784 0.500002 0.500000 Cr\n0.751215 0.499998 0.000001 Cr\n0.500002 0.248785 0.250001 Cr\n0.018304 0.739743 0.495073 O\n-0.018308 0.739740 0.004929 O\n0.512848 0.735087 0.994727 O\n0.487147 0.735087 0.505272 O\n0.264913 0.512849 0.744729 O\n0.735088 0.512849 0.755274 O\n0.264912 0.487157 0.255271 O\n0.260260 0.018311 0.245072 O\n0.487155 0.264910 0.494731 O\n0.512851 0.264914 0.005273 O\n0.018309 0.260260 0.504927 O\n-0.018306 0.260254 -0.004927 O\n0.739741 -0.018307 0.745073 O\n0.739743 0.018303 0.254927 O\n0.735085 0.487145 0.244728 O\n0.260255 -0.018306 0.754927 O\n",
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{
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"created_at": "2022-09-04T14:37:06.272291Z",
"updated_at": "2022-09-04T14:37:06.272328Z",
"structure_string": "K2 Na1 Ce1 Cl6\n1.0\n6.588984 -0.000000 3.804151\n2.196328 6.212153 3.804151\n-0.000000 -0.000000 7.608303\nK Na Ce Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Ce\n0.747227 0.252772 0.252773 Cl\n0.252773 0.252772 0.747227 Cl\n0.252773 0.747227 0.747227 Cl\n0.252773 0.747227 0.252772 Cl\n0.747227 0.252772 0.747227 Cl\n0.747227 0.747227 0.252772 Cl\n",
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{
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"structure_string": "Na10 Ta2 O10\n1.0\n5.941800 0.015872 -0.910814\n-2.878559 5.197994 -0.910814\n0.001076 0.001830 10.067998\nNa Ta O\n10 2 10\ndirect\n0.990923 0.675645 0.920962 Na\n0.009077 0.324354 0.079039 Na\n0.675645 0.990922 0.420962 Na\n0.331035 0.668964 0.750000 Na\n0.668965 0.331034 0.250000 Na\n0.554703 0.785361 0.048936 Na\n0.214639 0.445297 0.451065 Na\n0.445297 0.214638 0.951065 Na\n0.785361 0.554702 0.548936 Na\n0.324355 0.009077 0.579039 Na\n0.908249 0.091751 0.750001 Ta\n0.091751 0.908248 0.250000 Ta\n0.697648 0.037868 0.882598 O\n0.962132 0.302352 0.617403 O\n0.596014 0.809935 0.604645 O\n0.190064 0.403985 0.895356 O\n0.403986 0.190064 0.395356 O\n0.809936 0.596013 0.104645 O\n0.302352 0.962131 0.117403 O\n0.037868 0.697647 0.382598 O\n0.094824 0.905176 0.750000 O\n0.905176 0.094823 0.250000 O\n",
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{
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"structure_string": "Zn12 Si4 Ni8\n1.0\n6.589235 -0.000000 3.804296\n2.196412 6.212391 3.804296\n-0.000000 -0.000000 7.608594\nZn Si Ni\n12 4 8\ndirect\n0.939647 0.310354 0.939646 Zn\n0.939647 0.939646 0.310354 Zn\n0.310354 0.310354 0.939646 Zn\n0.060354 0.689646 0.689646 Zn\n0.310354 0.939646 0.939646 Zn\n0.689647 0.060354 0.689646 Zn\n0.689647 0.689646 0.060354 Zn\n0.060354 0.060354 0.689646 Zn\n0.060354 0.689646 0.060354 Zn\n0.310354 0.939646 0.310354 Zn\n0.939647 0.310354 0.310354 Zn\n0.689647 0.060354 0.060354 Zn\n0.500000 0.000000 0.500000 Si\n0.500000 0.500000 0.500000 Si\n-0.000000 0.500000 0.500000 Si\n0.500000 0.500000 0.000000 Si\n0.288251 0.288251 0.635249 Ni\n0.635249 0.288251 0.288251 Ni\n0.288251 0.288251 0.288251 Ni\n0.364751 0.711749 0.711749 Ni\n0.288251 0.635249 0.288251 Ni\n0.711749 0.711749 0.364752 Ni\n0.711749 0.364751 0.711749 Ni\n0.711749 0.711749 0.711749 Ni\n",
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}