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{
"id": "mp-559231",
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"structure_string": "Se16 S8 N16 Cl16\n1.0\n7.603872 0.000000 0.000000\n0.000000 10.877002 0.000000\n0.000000 0.000000 17.223629\nSe S N Cl\n16 8 16 16\ndirect\n0.716067 0.144880 0.073657 Se\n0.862270 0.450096 0.398037 Se\n0.637730 0.450096 0.898037 Se\n0.283933 0.855120 0.926343 Se\n0.716067 0.644880 0.426343 Se\n0.783933 0.644880 0.926343 Se\n0.362270 0.049904 0.398037 Se\n0.137730 0.549904 0.601963 Se\n0.216067 0.355120 0.073657 Se\n0.862270 0.950096 0.101963 Se\n0.783933 0.144880 0.573657 Se\n0.283933 0.355120 0.573657 Se\n0.362270 0.549904 0.101963 Se\n0.637730 0.950096 0.601963 Se\n0.216067 0.855120 0.426343 Se\n0.137730 0.049904 0.898037 Se\n0.790261 0.605392 0.261886 S\n0.209739 0.894608 0.761886 S\n0.290261 0.394608 0.238114 S\n0.709739 0.105392 0.738114 S\n0.709739 0.605392 0.761886 S\n0.790261 0.105392 0.238114 S\n0.290261 0.894608 0.261886 S\n0.209739 0.394608 0.738114 S\n0.377742 0.015692 0.295080 N\n0.877742 0.984308 0.204920 N\n0.206047 0.311947 0.174337 N\n0.293953 0.811947 0.825663 N\n0.706047 0.188053 0.174337 N\n0.706047 0.688053 0.325663 N\n0.793953 0.688053 0.825663 N\n0.293953 0.311947 0.674337 N\n0.206047 0.811947 0.325663 N\n0.622258 0.484308 0.795080 N\n0.122258 0.015692 0.795080 N\n0.793953 0.188053 0.674337 N\n0.122258 0.515692 0.704920 N\n0.877742 0.484308 0.295080 N\n0.622258 0.984308 0.704920 N\n0.377742 0.515692 0.204920 N\n0.320211 0.537819 0.933487 Cl\n0.895659 0.821412 0.612540 Cl\n0.679789 0.962181 0.433487 Cl\n0.395659 0.178588 0.887460 Cl\n0.179789 0.537819 0.433487 Cl\n0.179789 0.037819 0.066513 Cl\n0.604341 0.821412 0.112540 Cl\n0.320211 0.037819 0.566513 Cl\n0.820211 0.462181 0.566513 Cl\n0.395659 0.678588 0.612540 Cl\n0.104341 0.678588 0.112540 Cl\n0.604341 0.321412 0.387460 Cl\n0.820211 0.962181 0.933487 Cl\n0.104341 0.178588 0.387460 Cl\n0.679789 0.462181 0.066513 Cl\n0.895659 0.321412 0.887460 Cl\n",
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"spacegroup": 61
},
{
"id": "mp-18997",
"created_at": "2022-09-04T14:41:30.531620Z",
"structure_string": "Li4 Mn4 P4 O16\n1.0\n-0.000002 -0.000003 4.792029\n10.594184 -0.000009 -0.000004\n-0.000005 6.178591 -0.000003\nLi Mn P O\n4 4 4 16\ndirect\n0.000000 0.000002 0.999999 Li\n0.499998 0.500002 0.500001 Li\n0.000000 0.000002 0.500002 Li\n0.499998 0.500002 0.000000 Li\n0.972549 0.281163 0.250030 Mn\n0.527468 0.781143 0.250012 Mn\n0.027420 0.718829 0.749970 Mn\n0.472580 0.218824 0.749963 Mn\n0.589559 0.907901 0.750000 P\n0.910440 0.407901 0.749999 P\n0.410443 0.092102 0.250004 P\n0.089557 0.592102 0.250001 P\n0.268652 0.903415 0.750000 O\n0.231347 0.403417 0.750001 O\n0.731348 0.096588 0.250002 O\n0.768651 0.596586 0.250001 O\n0.789975 0.544350 0.750001 O\n0.710021 0.044350 0.750001 O\n0.210023 0.455653 0.250001 O\n0.289977 0.955653 0.250001 O\n0.722526 0.838918 0.950543 O\n0.777472 0.338918 0.549458 O\n0.277475 0.161086 0.450545 O\n0.222524 0.661086 0.049459 O\n0.277474 0.161085 0.049458 O\n0.222524 0.661085 0.450544 O\n0.722528 0.838918 0.549459 O\n0.777472 0.338918 0.950545 O\n",
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{
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"structure_string": "Ca8 As8 H56 O56\n1.0\n10.853822 0.000000 0.000000\n0.000000 11.117913 0.000000\n0.000000 0.000000 11.370860\nCa As H O\n8 8 56 56\ndirect\n0.086036 0.248565 0.199568 Ca\n0.586036 0.751435 0.300432 Ca\n0.913964 0.251435 0.699568 Ca\n0.413964 0.748565 0.800432 Ca\n0.913964 0.751435 0.800432 Ca\n0.413964 0.248565 0.699568 Ca\n0.086036 0.748565 0.300432 Ca\n0.586036 0.251435 0.199568 Ca\n0.650671 0.367089 0.503564 As\n0.150671 0.632911 0.996436 As\n0.349329 0.132911 0.003564 As\n0.849329 0.867089 0.496436 As\n0.349329 0.632911 0.496436 As\n0.849329 0.367089 0.003564 As\n0.650671 0.867089 0.996436 As\n0.150671 0.132911 0.503564 As\n0.842964 0.326126 0.339860 H\n0.342964 0.673874 0.160140 H\n0.157036 0.173874 0.839860 H\n0.657036 0.826126 0.660140 H\n0.157036 0.673874 0.660140 H\n0.657036 0.326126 0.839860 H\n0.842964 0.826126 0.160140 H\n0.342964 0.173874 0.339860 H\n0.952454 0.274988 0.416552 H\n0.452454 0.725012 0.083448 H\n0.047546 0.225012 0.916552 H\n0.547546 0.774988 0.583448 H\n0.047546 0.725012 0.583448 H\n0.547546 0.274988 0.916552 H\n0.952454 0.774988 0.083448 H\n0.452454 0.225012 0.416552 H\n0.870462 0.105344 0.131453 H\n0.370462 0.894656 0.368547 H\n0.129538 0.394656 0.631453 H\n0.629538 0.605344 0.868547 H\n0.129538 0.894656 0.868547 H\n0.629538 0.105344 0.631453 H\n0.870462 0.605344 0.368547 H\n0.370462 0.394656 0.131453 H\n0.961171 0.994750 0.142614 H\n0.461171 0.005250 0.357386 H\n0.038829 0.505250 0.642614 H\n0.538829 0.494750 0.857386 H\n0.038829 0.005250 0.857386 H\n0.538829 0.994750 0.642614 H\n0.961171 0.494750 0.357386 H\n0.461171 0.505250 0.142614 H\n0.186626 0.506021 0.212379 H\n0.686626 0.493979 0.287621 H\n0.813374 0.993979 0.712379 H\n0.313374 0.006021 0.787621 H\n0.813374 0.493979 0.787621 H\n0.313374 0.506021 0.712379 H\n0.186626 0.006021 0.287621 H\n0.686626 0.993979 0.212379 H\n0.236489 0.443086 0.328294 H\n0.736489 0.556914 0.171706 H\n0.763511 0.056914 0.828294 H\n0.263511 0.943086 0.671706 H\n0.763511 0.556914 0.671706 H\n0.263511 0.443086 0.828294 H\n0.236489 0.943086 0.171706 H\n0.736489 0.056914 0.328294 H\n0.606247 0.573239 0.518244 H\n0.106247 0.426761 0.981756 H\n0.393753 0.926761 0.018244 H\n0.893753 0.073239 0.481756 H\n0.393753 0.426761 0.481756 H\n0.893753 0.573239 0.018244 H\n0.606247 0.073239 0.981756 H\n0.106247 0.926761 0.518244 H\n0.934865 0.321921 0.343836 O\n0.434865 0.678079 0.156164 O\n0.065135 0.178079 0.843836 O\n0.565135 0.821921 0.656164 O\n0.065135 0.678079 0.656164 O\n0.565135 0.321921 0.843836 O\n0.934865 0.821921 0.156164 O\n0.434865 0.178079 0.343836 O\n0.957330 0.083477 0.141339 O\n0.457330 0.916523 0.358661 O\n0.042670 0.416523 0.641339 O\n0.542670 0.583477 0.858661 O\n0.042670 0.916523 0.858661 O\n0.542670 0.083477 0.641339 O\n0.957330 0.583477 0.358661 O\n0.457330 0.416523 0.141339 O\n0.188624 0.428078 0.255596 O\n0.688624 0.571922 0.244404 O\n0.811376 0.071922 0.755596 O\n0.311376 0.928078 0.744404 O\n0.811376 0.571922 0.744404 O\n0.311376 0.428078 0.755596 O\n0.188624 0.928078 0.244404 O\n0.688624 0.071922 0.255596 O\n0.677796 0.519152 0.543966 O\n0.177796 0.480848 0.956034 O\n0.322204 0.980848 0.043966 O\n0.822204 0.019152 0.456034 O\n0.322204 0.480848 0.456034 O\n0.822204 0.519152 0.043966 O\n0.677796 0.019152 0.956034 O\n0.177796 0.980848 0.543966 O\n0.741202 0.283197 0.590518 O\n0.241202 0.716803 0.909482 O\n0.258798 0.216803 0.090518 O\n0.758798 0.783197 0.409482 O\n0.258798 0.716803 0.409482 O\n0.758798 0.283197 0.090518 O\n0.741202 0.783197 0.909482 O\n0.241202 0.216803 0.590518 O\n0.683626 0.354721 0.356023 O\n0.183626 0.645279 0.143977 O\n0.316374 0.145279 0.856023 O\n0.816374 0.854721 0.643977 O\n0.316374 0.645279 0.643977 O\n0.816374 0.354721 0.856023 O\n0.683626 0.854721 0.143977 O\n0.183626 0.145279 0.356023 O\n0.496585 0.336719 0.526276 O\n0.996585 0.663281 0.973724 O\n0.503415 0.163281 0.026276 O\n0.003415 0.836719 0.473724 O\n0.503415 0.663281 0.473724 O\n0.003415 0.336719 0.026276 O\n0.496585 0.836719 0.973724 O\n0.996585 0.163281 0.526276 O\n",
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{
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{
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{
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{
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