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{
"id": "jvasp-86718",
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{
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"structure_string": "Na2 Cr3 Se6\n1.0\n6.256717 0.000655 0.902224\n-3.323953 5.300740 0.902224\n0.014340 0.025922 7.280618\nNa Cr Se\n2 3 6\ndirect\n0.166661 0.833339 0.500000 Na\n0.833340 0.166659 0.500000 Na\n0.000000 0.000000 0.000000 Cr\n0.333135 0.666865 -0.000001 Cr\n0.666865 0.333134 -0.000000 Cr\n0.931234 0.599319 0.202040 Se\n0.267185 0.267184 0.203095 Se\n0.599320 0.931233 0.202040 Se\n0.732815 0.732814 0.796905 Se\n0.068767 0.400680 0.797960 Se\n0.400680 0.068766 0.797960 Se\n",
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{
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"created_at": "2022-09-04T14:38:32.538254Z",
"updated_at": "2022-09-04T14:38:32.538274Z",
"structure_string": "Pr2 Zn6 Ge3\n1.0\n3.849539 -6.667597 -0.000000\n3.849539 6.667597 0.000000\n-0.000000 0.000000 4.127499\nPr Zn Ge\n2 6 3\ndirect\n0.666667 0.333333 0.000000 Pr\n0.333333 0.666667 0.000000 Pr\n-0.000000 0.287852 0.500000 Zn\n0.287852 -0.000000 0.500000 Zn\n-0.000000 0.811362 0.000000 Zn\n0.188639 0.188639 0.000000 Zn\n0.712149 0.712149 0.500000 Zn\n0.811362 -0.000000 0.000000 Zn\n-0.000000 0.617598 0.500000 Ge\n0.382403 0.382403 0.500000 Ge\n0.617598 -0.000000 0.500000 Ge\n",
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{
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"created_at": "2022-09-04T14:38:34.531569Z",
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"structure_string": "Sm2 Zn6 Ge3\n1.0\n3.821767 -6.619496 -0.000000\n3.821767 6.619496 0.000000\n-0.000000 -0.000000 4.060666\nSm Zn Ge\n2 6 3\ndirect\n0.666667 0.333333 0.000000 Sm\n0.333333 0.666667 0.000000 Sm\n0.000000 0.285087 0.500000 Zn\n0.285087 0.000000 0.500000 Zn\n0.000000 0.809895 0.000000 Zn\n0.190106 0.190106 0.000000 Zn\n0.714914 0.714914 0.500000 Zn\n0.809895 0.000000 0.000000 Zn\n0.000000 0.612347 0.500000 Ge\n0.387653 0.387653 0.500000 Ge\n0.612347 0.000000 0.500000 Ge\n",
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{
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"created_at": "2022-09-04T14:38:46.605268Z",
"updated_at": "2022-09-04T14:38:46.605296Z",
"structure_string": "Zn3 In2 O6\n1.0\n3.414695 -0.000346 13.815005\n1.681746 2.971846 13.815005\n-0.000594 -0.000346 14.230759\nZn In O\n3 2 6\ndirect\n0.262336 0.262335 0.262336 Zn\n0.738186 0.738184 0.738185 Zn\n0.131157 0.131157 0.131157 Zn\n0.000311 0.000311 0.000311 In\n0.863223 0.863220 0.863221 In\n0.915199 0.915196 0.915197 O\n0.083976 0.083976 0.083976 O\n0.195177 0.195176 0.195177 O\n0.810555 0.810553 0.810554 O\n0.308695 0.308694 0.308695 O\n0.691240 0.691237 0.691239 O\n",
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{
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"created_at": "2022-09-04T14:38:41.546857Z",
"updated_at": "2022-09-04T14:38:41.546885Z",
"structure_string": "Y6 Ga4 Ni12\n1.0\n7.265011 -0.000000 -2.568570\n-3.632506 6.291685 -2.568570\n0.000000 0.000000 7.705709\nY Ga Ni\n6 4 12\ndirect\n0.708905 0.708906 0.000000 Y\n0.291095 -0.000000 0.291095 Y\n-0.000000 0.291095 0.291095 Y\n0.291095 0.291095 0.000000 Y\n0.708905 -0.000000 0.708905 Y\n-0.000000 0.708906 0.708905 Y\n-0.000000 -0.000000 0.500000 Ga\n-0.000000 0.500000 0.000000 Ga\n0.500000 0.000000 -0.000000 Ga\n0.500000 0.500000 0.500000 Ga\n0.664187 0.664188 0.328373 Ni\n0.671627 0.335813 0.335813 Ni\n0.335813 -0.000000 0.664187 Ni\n0.335813 0.664188 0.000000 Ni\n-0.000000 0.335813 0.664187 Ni\n0.335813 0.335813 0.671627 Ni\n0.664187 0.335813 -0.000000 Ni\n-0.000000 0.664188 0.335813 Ni\n0.664187 -0.000000 0.335813 Ni\n0.664187 0.328373 0.664187 Ni\n0.335813 0.671627 0.335813 Ni\n0.328373 0.664188 0.664187 Ni\n",
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{
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"structure_string": "Er6 Si4 Ni12\n1.0\n7.102069 -0.000000 -2.510960\n-3.551034 6.150572 -2.510960\n-0.000000 -0.000000 7.532881\nEr Si Ni\n6 4 12\ndirect\n0.713376 0.713376 0.000000 Er\n0.286624 0.000000 0.286624 Er\n0.000000 0.286624 0.286624 Er\n0.286624 0.286624 0.000000 Er\n0.713376 0.000000 0.713376 Er\n0.000000 0.713376 0.713376 Er\n0.000000 0.000000 0.500000 Si\n0.000000 0.500000 0.000000 Si\n0.500000 0.000000 0.000000 Si\n0.500000 0.500000 0.500000 Si\n0.669633 0.669632 0.339264 Ni\n0.660737 0.330368 0.330368 Ni\n0.330368 0.000000 0.669632 Ni\n0.330368 0.669632 0.000000 Ni\n0.000000 0.330368 0.669632 Ni\n0.330368 0.330368 0.660736 Ni\n0.669633 0.330368 0.000000 Ni\n0.000000 0.669632 0.330368 Ni\n0.669632 0.000000 0.330368 Ni\n0.669633 0.339263 0.669632 Ni\n0.330368 0.660736 0.330368 Ni\n0.339264 0.669632 0.669632 Ni\n",
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"created_at": "2022-09-04T14:38:33.711384Z",
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"structure_string": "Nd2 Zn6 Ge3\n1.0\n3.838472 -6.648429 0.000000\n3.838472 6.648429 0.000000\n-0.000000 -0.000000 4.104435\nNd Zn Ge\n2 6 3\ndirect\n0.666667 0.333333 0.000000 Nd\n0.333333 0.666667 0.000000 Nd\n-0.000000 0.712962 0.499999 Zn\n0.287037 0.287037 0.499999 Zn\n-0.000000 0.189158 0.000000 Zn\n0.189158 -0.000000 0.000000 Zn\n0.712962 -0.000000 0.499999 Zn\n0.810842 0.810842 0.000000 Zn\n-0.000000 0.384120 0.499999 Ge\n0.384120 -0.000000 0.499999 Ge\n0.615880 0.615880 0.499999 Ge\n",
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"structure_string": "Li4 V6 O12\n1.0\n4.946865 -0.005135 0.669460\n-0.786809 6.492611 -0.799222\n0.010054 -0.080643 6.588251\nLi V O\n4 6 12\ndirect\n-0.000002 0.669886 0.669888 Li\n0.500001 0.169887 0.169885 Li\n0.000001 0.330096 0.330096 Li\n0.500000 0.830098 0.830097 Li\n0.250007 0.750004 0.250006 V\n0.250002 0.092857 0.592856 V\n0.749999 0.907146 0.407146 V\n0.749992 0.250010 0.750007 V\n0.749998 0.592859 0.092861 V\n0.250002 0.407144 0.907142 V\n0.127322 0.031549 0.313417 O\n0.627321 0.531555 0.813417 O\n0.872678 0.968463 0.686581 O\n0.372679 0.468457 0.186580 O\n0.372679 0.813415 0.531552 O\n0.384853 0.132891 0.867110 O\n0.115140 0.367106 0.632894 O\n0.615147 0.867111 0.132894 O\n0.884859 0.632898 0.367108 O\n0.127321 0.686577 0.968460 O\n0.872679 0.313420 0.031550 O\n0.627321 0.186584 0.468459 O\n",
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"structure_string": "Al6 C3 N2\n1.0\n-3.479176 0.002774 0.018118\n-0.003972 -4.189334 -0.046077\n0.048214 1.846690 9.031321\nAl C N\n6 3 2\ndirect\n0.138236 0.724368 0.749213 Al\n0.138749 0.922733 0.394296 Al\n0.638266 0.488912 0.513820 Al\n0.138072 0.373498 0.143613 Al\n0.638197 0.241253 0.834497 Al\n0.638117 0.839243 0.063791 Al\n0.138100 0.898595 0.183212 C\n0.138288 0.297343 0.577008 C\n0.638228 0.737049 0.837269 C\n0.638090 0.334894 0.052123 N\n0.138228 0.168802 0.715970 N\n",
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