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{
"id": "mp-1078815",
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"structure_string": "Nb2 Se8\n1.0\n5.970832 0.000000 0.000000\n0.000000 5.970832 0.000000\n0.000000 0.000000 6.526190\nNb Se\n2 8\ndirect\n0.000000 0.000000 0.750000 Nb\n0.000000 0.000000 0.250000 Nb\n0.334024 0.136251 0.500000 Se\n0.665976 0.863749 0.500000 Se\n0.334024 0.863749 0.000000 Se\n0.665976 0.136251 0.000000 Se\n0.136251 0.665976 0.500000 Se\n0.863749 0.334024 0.500000 Se\n0.863749 0.665976 0.000000 Se\n0.136251 0.334024 0.000000 Se\n",
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{
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"structure_string": "Yb6 Sn10\n1.0\n4.126854 -5.074898 0.000000\n4.126854 5.074898 0.000000\n0.000000 0.000000 10.510267\nYb Sn\n6 10\ndirect\n0.123861 0.123861 0.250000 Yb\n0.876139 0.876139 0.750000 Yb\n0.294008 0.705992 0.500000 Yb\n0.294008 0.705992 0.000000 Yb\n0.705992 0.294008 0.500000 Yb\n0.705992 0.294008 0.000000 Yb\n0.998237 0.570996 0.250000 Sn\n0.429004 0.001763 0.750000 Sn\n0.001763 0.429004 0.750000 Sn\n0.570996 0.998237 0.250000 Sn\n0.804872 0.804872 0.044880 Sn\n0.195128 0.195128 0.955120 Sn\n0.804872 0.804872 0.455120 Sn\n0.195128 0.195128 0.544880 Sn\n0.518324 0.518324 0.250000 Sn\n0.481676 0.481676 0.750000 Sn\n",
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{
"id": "mp-1183425",
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"structure_string": "Be6 Co2\n1.0\n2.297259 -3.978969 0.000000\n2.297259 3.978969 0.000000\n0.000000 0.000000 3.630857\nBe Co\n6 2\ndirect\n0.165980 0.331961 0.250000 Be\n0.668039 0.834020 0.250000 Be\n0.165980 0.834020 0.250000 Be\n0.834020 0.668039 0.750000 Be\n0.331961 0.165980 0.750000 Be\n0.834020 0.165980 0.750000 Be\n0.333333 0.666667 0.750000 Co\n0.666667 0.333333 0.250000 Co\n",
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{
"id": "mp-1192157",
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"structure_string": "Hf16 Mn8\n1.0\n0.000000 6.001789 6.001789\n6.001789 0.000000 6.001789\n6.001789 6.001789 0.000000\nHf Mn\n16 8\ndirect\n0.125000 0.625000 0.625000 Hf\n0.625000 0.125000 0.625000 Hf\n0.625000 0.625000 0.125000 Hf\n0.625000 0.625000 0.625000 Hf\n0.810929 0.810929 0.189071 Hf\n0.189071 0.189071 0.810929 Hf\n0.810929 0.189071 0.810929 Hf\n0.189071 0.810929 0.189071 Hf\n0.189071 0.810929 0.810929 Hf\n0.810929 0.189071 0.189071 Hf\n0.439071 0.439071 0.060929 Hf\n0.060929 0.060929 0.439071 Hf\n0.439071 0.060929 0.439071 Hf\n0.060929 0.439071 0.060929 Hf\n0.060929 0.439071 0.439071 Hf\n0.439071 0.060929 0.060929 Hf\n0.755509 0.414830 0.414830 Mn\n0.414830 0.755509 0.414830 Mn\n0.414830 0.414830 0.755509 Mn\n0.414830 0.414830 0.414830 Mn\n0.494491 0.835170 0.835170 Mn\n0.835170 0.494491 0.835170 Mn\n0.835170 0.835170 0.494491 Mn\n0.835170 0.835170 0.835170 Mn\n",
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"formula_full": "Hf16 Mn8",
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{
"id": "mp-974584",
"created_at": "2022-09-04T14:46:08.855337Z",
"structure_string": "Re1 Au3\n1.0\n-2.104451 2.104451 3.869979\n2.104451 -2.104451 3.869979\n2.104451 2.104451 -3.869979\nRe Au\n1 3\ndirect\n0.000000 0.000000 0.000000 Re\n0.750000 0.250000 0.500000 Au\n0.250000 0.750000 0.500000 Au\n0.500000 0.500000 0.000000 Au\n",
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"spacegroup": 139
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{
"id": "mp-17013",
"created_at": "2022-09-04T14:45:59.761786Z",
"structure_string": "Ta10 Ge6\n1.0\n3.827295 -6.629070 0.000000\n3.827295 6.629070 0.000000\n0.000000 0.000000 5.346568\nTa Ge\n10 6\ndirect\n0.000000 0.762506 0.750000 Ta\n0.000000 0.237494 0.250000 Ta\n0.762506 0.762506 0.250000 Ta\n0.762506 0.000000 0.750000 Ta\n0.237494 0.237494 0.750000 Ta\n0.237494 0.000000 0.250000 Ta\n0.333333 0.666667 0.500000 Ta\n0.666667 0.333333 0.000000 Ta\n0.666667 0.333333 0.500000 Ta\n0.333333 0.666667 0.000000 Ta\n0.397040 0.000000 0.750000 Ge\n0.397040 0.397040 0.250000 Ge\n0.000000 0.602960 0.250000 Ge\n0.000000 0.397040 0.750000 Ge\n0.602960 0.602960 0.750000 Ge\n0.602960 0.000000 0.250000 Ge\n",
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"formula_full": "Ta10 Ge6",
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{
"id": "mp-999203",
"created_at": "2022-09-04T14:45:53.113518Z",
"structure_string": "Sc2 C2\n1.0\n1.608451 -2.785919 0.000000\n1.608451 2.785919 0.000000\n0.000000 0.000000 5.954552\nSc C\n2 2\ndirect\n0.000000 0.000000 0.500000 Sc\n0.000000 0.000000 0.000000 Sc\n0.333333 0.666667 0.250000 C\n0.666667 0.333333 0.750000 C\n",
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"spacegroup": 194
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{
"id": "mp-972084",
"created_at": "2022-09-04T14:45:55.413408Z",
"structure_string": "Tb1 Mn12\n1.0\n-4.172885 4.172885 2.319019\n4.172885 -4.172885 2.319019\n4.172885 4.172885 -2.319019\nTb Mn\n1 12\ndirect\n0.000000 0.000000 0.000000 Tb\n0.499999 0.499999 0.500000 Mn\n0.000001 0.000001 0.500000 Mn\n0.500000 0.999999 0.000000 Mn\n0.999999 0.500000 0.000000 Mn\n0.000000 0.361369 0.361369 Mn\n0.000000 0.638633 0.638633 Mn\n0.638633 0.000000 0.638633 Mn\n0.361369 0.000000 0.361369 Mn\n0.500001 0.271245 0.771246 Mn\n0.500000 0.728755 0.228754 Mn\n0.728755 0.500000 0.228754 Mn\n0.271245 0.500001 0.771246 Mn\n",
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{
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"structure_string": "Yb2 Zn4\n1.0\n-2.275264 3.619197 3.753917\n2.275264 -3.619197 3.753917\n2.275264 3.619197 -3.753917\nYb Zn\n2 4\ndirect\n0.700544 0.450544 0.250000 Yb\n0.299456 0.549456 0.750000 Yb\n0.724223 0.164179 0.560044 Zn\n0.275777 0.835821 0.439956 Zn\n0.104135 0.164179 0.939956 Zn\n0.895865 0.835821 0.060044 Zn\n",
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{
"id": "mp-1185792",
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"structure_string": "Mg3 Tl1\n1.0\n-2.247721 2.247721 4.608875\n2.247721 -2.247721 4.608875\n2.247721 2.247721 -4.608875\nMg Tl\n3 1\ndirect\n0.500000 0.500000 0.000000 Mg\n0.750000 0.250000 0.500000 Mg\n0.250000 0.750000 0.500000 Mg\n0.000000 0.000000 0.000000 Tl\n",
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{
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"structure_string": "Ca8 Ge4\n1.0\n4.855452 0.000000 0.000000\n0.000000 7.678138 0.000000\n0.000000 0.000000 9.100631\nCa Ge\n8 4\ndirect\n0.750000 0.346544 0.074115 Ca\n0.250000 0.653456 0.925885 Ca\n0.750000 0.846544 0.425885 Ca\n0.250000 0.153456 0.574115 Ca\n0.750000 0.480171 0.677202 Ca\n0.250000 0.519829 0.322798 Ca\n0.750000 0.980171 0.822798 Ca\n0.250000 0.019829 0.177202 Ca\n0.750000 0.747667 0.105558 Ge\n0.250000 0.252333 0.894442 Ge\n0.750000 0.247667 0.394442 Ge\n0.250000 0.752333 0.605558 Ge\n",
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{
"id": "mp-1075045",
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"structure_string": "Mg6 Si8\n1.0\n3.724328 0.000000 0.000000\n-1.749847 8.464198 0.000000\n-0.079707 -4.219478 8.630354\nMg Si\n6 8\ndirect\n0.926802 0.438080 0.324103 Mg\n0.293107 0.134146 0.067071 Mg\n0.709186 0.969107 0.243551 Mg\n0.834783 0.211539 0.588795 Mg\n0.512663 0.577073 0.632250 Mg\n0.066782 0.690022 0.966055 Mg\n0.334684 0.236866 0.386180 Si\n0.429143 0.409809 0.832256 Si\n0.702852 0.966259 0.713745 Si\n0.619731 0.781734 0.437457 Si\n0.089706 0.725086 0.260571 Si\n0.863123 0.273155 0.904565 Si\n0.463109 0.491683 0.112534 Si\n0.147728 0.848729 0.784237 Si\n",
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]
}