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"id": "jvasp-68727",
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"structure_string": "Ba4 Zr3 S10\n1.0\n4.973573 0.008377 -0.689001\n-0.103874 4.972495 -0.689001\n-0.007132 -0.007295 18.243751\nBa Zr S\n4 3 10\ndirect\n0.699882 0.699882 0.399764 Ba\n0.567706 0.567705 0.135411 Ba\n0.432295 0.432295 0.864589 Ba\n0.300119 0.300119 0.600236 Ba\n0.142875 0.142875 0.285749 Zr\n0.857126 0.857126 0.714251 Zr\n0.000000 0.000000 0.000000 Zr\n0.786875 0.786875 0.573750 S\n0.860980 0.360981 0.721960 S\n0.213126 0.213126 0.426250 S\n0.500000 0.000000 0.000000 S\n0.000000 0.500000 0.000000 S\n0.360981 0.860980 0.721960 S\n0.139020 0.639020 0.278040 S\n0.639020 0.139020 0.278040 S\n0.929535 0.929535 0.859071 S\n0.070465 0.070465 0.140929 S\n",
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"formula_full": "Ba4 Zr3 S10",
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"created_at": "2022-09-04T14:37:41.100664Z",
"updated_at": "2022-09-04T14:37:41.100686Z",
"structure_string": "Ba2 Cu1 Br1 O2\n1.0\n4.208566 -0.013878 9.203932\n1.993377 3.706572 9.203932\n-0.023310 -0.013878 10.120466\nBa Cu Br O\n2 1 1 2\ndirect\n0.747754 0.747751 0.747752 Ba\n0.252251 0.252250 0.252250 Ba\n0.500000 0.499998 0.499998 Cu\n0.000000 0.000000 0.000000 Br\n0.438407 0.438406 0.438406 O\n0.561593 0.561592 0.561592 O\n",
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{
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"created_at": "2022-09-04T14:36:33.625019Z",
"updated_at": "2022-09-04T14:36:33.625041Z",
"structure_string": "Tm2 Cl6\n1.0\n5.702133 0.001494 4.110234\n2.104805 5.299445 4.110234\n0.002201 0.001494 7.029106\nTm Cl\n2 6\ndirect\n0.500000 0.500000 0.500000 Tm\n0.000000 0.000000 0.000000 Tm\n0.417406 0.750000 0.082593 Cl\n0.750000 0.082593 0.417406 Cl\n0.917406 0.582594 0.249999 Cl\n0.250001 0.917406 0.582593 Cl\n0.582594 0.249999 0.917406 Cl\n0.082594 0.417406 0.750000 Cl\n",
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{
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"created_at": "2022-09-04T14:38:41.071391Z",
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"structure_string": "I2 N2\n1.0\n5.916454 0.283767 -0.763182\n-0.854206 -7.629946 -0.156155\n-1.782966 1.242394 -2.087746\nI N\n2 2\ndirect\n0.031362 0.020769 -0.107705 I\n0.334637 0.624042 0.724490 I\n0.723633 0.405485 0.423539 N\n0.642529 0.239412 0.193578 N\n",
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"updated_at": "2022-09-04T14:37:53.129958Z",
"structure_string": "Yb2 Cd1 In1\n1.0\n0.000000 3.758158 3.758158\n3.758158 0.000000 3.758158\n3.758158 3.758158 0.000000\nYb Cd In\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500001 0.500001 0.500001 Yb\n0.250001 0.250001 0.250001 Cd\n0.750000 0.750000 0.750000 In\n",
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"created_at": "2022-09-04T14:36:57.367739Z",
"updated_at": "2022-09-04T14:36:57.367760Z",
"structure_string": "Y1 Tm1 Tl2\n1.0\n4.602885 -0.000000 2.657477\n1.534295 4.339642 2.657477\n-0.000000 -0.000000 5.314954\nY Tm Tl\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.499999 0.500000 0.500001 Tm\n0.249999 0.250000 0.250000 Tl\n0.749998 0.750000 0.750001 Tl\n",
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{
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"created_at": "2022-09-04T14:38:47.038000Z",
"updated_at": "2022-09-04T14:38:47.038028Z",
"structure_string": "Ca9 Sn3 S15\n1.0\n8.483499 0.071715 3.428696\n3.663908 7.651841 3.428696\n0.449990 0.286112 11.338382\nCa Sn S\n9 3 15\ndirect\n0.269451 0.770960 0.644162 Ca\n0.301428 0.301428 0.703351 Ca\n0.692723 0.692723 0.383382 Ca\n0.984665 0.559818 0.001743 Ca\n0.522873 0.522873 -0.032058 Ca\n0.282062 0.708155 0.293439 Ca\n0.708155 0.282063 0.293439 Ca\n0.770960 0.269451 0.644162 Ca\n0.559818 0.984665 0.001743 Ca\n0.000539 0.000539 -0.014681 Sn\n0.221661 0.221661 0.380400 Sn\n0.793009 0.793009 0.622764 Sn\n0.369823 0.369823 0.902551 S\n0.830996 0.830997 0.135505 S\n0.625009 0.625009 0.673991 S\n0.295228 0.865229 0.011857 S\n0.865229 0.295228 0.011857 S\n0.629170 0.629170 0.123136 S\n0.485194 0.485194 0.497387 S\n-0.057354 -0.057354 0.820190 S\n0.389522 0.389522 0.241136 S\n0.927154 0.353100 0.355055 S\n0.353099 0.927154 0.355055 S\n0.033662 0.613254 0.724532 S\n0.883210 0.883210 0.383755 S\n0.165962 0.165962 0.616220 S\n0.613254 0.033662 0.724532 S\n",
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{
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