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{
"id": "mp-1205375",
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"structure_string": "La2 Mn2 O6\n1.0\n-0.000009 0.000008 3.995510\n5.564051 -0.002699 -0.000013\n-0.002700 5.565343 0.000011\nLa Mn O\n2 2 6\ndirect\n0.500001 0.500001 0.000001 La\n0.500000 0.999999 0.499997 La\n0.999999 0.500000 0.500001 Mn\n0.000000 0.000001 0.999998 Mn\n0.499998 0.499999 0.500000 O\n0.499999 0.999999 0.000002 O\n0.999995 0.695926 0.804226 O\n0.999999 0.804049 0.304252 O\n0.000006 0.304076 0.195775 O\n0.000002 0.195951 0.695748 O\n",
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{
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"structure_string": "Mn2 Ga4 P6 H8 N2 O28\n1.0\n5.089545 6.654554 0.000000\n-5.089545 6.654554 0.000000\n0.000000 2.840895 8.691734\nMn Ga P H N O\n2 4 6 8 2 28\ndirect\n0.227940 0.772060 0.750000 Mn\n0.772060 0.227940 0.250000 Mn\n0.601870 0.754121 0.936753 Ga\n0.245879 0.398130 0.563247 Ga\n0.398130 0.245879 0.063247 Ga\n0.754121 0.601870 0.436753 Ga\n0.505186 0.494814 0.250000 P\n0.494814 0.505186 0.750000 P\n0.664912 0.919474 0.179777 P\n0.080526 0.335088 0.320223 P\n0.335088 0.080526 0.820223 P\n0.919474 0.664912 0.679777 P\n0.271055 0.032834 0.495987 H\n0.967166 0.728945 0.004013 H\n0.728945 0.967166 0.504013 H\n0.032834 0.271055 0.995987 H\n0.417983 0.879438 0.444655 H\n0.120562 0.582017 0.055345 H\n0.582018 0.120562 0.555345 H\n0.879438 0.417983 0.944655 H\n0.863412 0.136588 0.750000 N\n0.136588 0.863412 0.250000 N\n0.476523 0.640027 0.113729 O\n0.359973 0.523477 0.386271 O\n0.523477 0.359973 0.886271 O\n0.640027 0.476523 0.613729 O\n0.203142 0.985086 0.815852 O\n0.014914 0.796858 0.684148 O\n0.796858 0.014914 0.184148 O\n0.985086 0.203142 0.315852 O\n0.462985 0.679954 0.800360 O\n0.320046 0.537015 0.699640 O\n0.537015 0.320046 0.199640 O\n0.679954 0.462985 0.300360 O\n0.316931 0.910477 0.521876 O\n0.089523 0.683069 0.978124 O\n0.683069 0.089523 0.478124 O\n0.910477 0.316931 0.021876 O\n0.737238 0.818469 0.048167 O\n0.181531 0.262762 0.451833 O\n0.262762 0.181531 0.951833 O\n0.818469 0.737238 0.548167 O\n0.510289 0.967668 0.840345 O\n0.032332 0.489711 0.659655 O\n0.489711 0.032332 0.159655 O\n0.967668 0.510289 0.340345 O\n0.794112 0.622407 0.835548 O\n0.377593 0.205888 0.664452 O\n0.205888 0.377593 0.164452 O\n0.622407 0.794112 0.335548 O\n",
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"formula_full": "Mn2 Ga4 P6 H8 N2 O28",
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"spacegroup": 15
},
{
"id": "mp-1225698",
"created_at": "2022-09-04T14:40:54.758899Z",
"structure_string": "Cu3 Ni1\n1.0\n1.407698 -2.018348 0.000000\n1.407698 2.018348 0.000000\n0.000000 0.000000 8.094515\nCu Ni\n3 1\ndirect\n0.500000 0.500000 0.755085 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.500000 0.244915 Cu\n0.000000 0.000000 0.000000 Ni\n",
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"density": 9.00118531508023,
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},
{
"id": "mp-1033571",
"created_at": "2022-09-04T14:40:54.798737Z",
"structure_string": "Cs1 Mg6 C1 O8\n1.0\n9.388173 -0.000000 0.000000\n-0.000000 4.447233 0.000000\n-0.000000 0.000000 4.447233\nCs Mg C O\n1 6 1 8\ndirect\n0.000000 0.000000 -0.000000 Cs\n0.500000 0.000000 -0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.276046 0.000000 0.500000 Mg\n0.723954 -0.000000 0.500000 Mg\n0.276046 0.500000 0.000000 Mg\n0.723954 0.500000 -0.000000 Mg\n0.000000 0.500000 0.500000 C\n0.287936 0.000000 0.000000 O\n0.712064 -0.000000 -0.000000 O\n0.267408 0.500000 0.500000 O\n0.732592 0.500000 0.500000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 -0.000000 O\n0.500000 0.500000 -0.000000 O\n",
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"volume": 185.67817174631577,
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"formula_full": "Cs1 Mg6 C1 O8",
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},
{
"id": "mp-1181112",
"created_at": "2022-09-04T14:40:54.852249Z",
"structure_string": "Na16 Xe4 O56\n1.0\n9.843515 0.000000 0.000000\n0.000000 11.248110 0.000000\n0.000000 0.000000 11.556215\nNa Xe O\n16 4 56\ndirect\n0.553344 0.967673 0.134500 Na\n0.946656 0.467673 0.365500 Na\n0.946656 0.032327 0.634500 Na\n0.553344 0.532327 0.865500 Na\n0.446656 0.032327 0.865500 Na\n0.053344 0.532327 0.634500 Na\n0.053344 0.967673 0.365500 Na\n0.446656 0.467673 0.134500 Na\n0.768773 0.748139 0.362516 Na\n0.731227 0.248139 0.137484 Na\n0.731227 0.251861 0.862516 Na\n0.768773 0.751861 0.637484 Na\n0.231227 0.251861 0.637484 Na\n0.268773 0.751861 0.862516 Na\n0.268773 0.748139 0.137484 Na\n0.231227 0.248139 0.362516 Na\n0.906450 0.750000 0.000000 Xe\n0.593550 0.250000 0.500000 Xe\n0.093550 0.250000 0.000000 Xe\n0.406449 0.750000 0.500000 Xe\n0.582800 0.750000 0.000000 O\n0.917200 0.250000 0.500000 O\n0.417200 0.250000 0.000000 O\n0.082800 0.750000 0.500000 O\n0.112857 0.750000 0.000000 O\n0.387143 0.250000 0.500000 O\n0.887143 0.250000 0.000000 O\n0.612857 0.750000 0.500000 O\n0.852422 0.975278 0.158340 O\n0.647578 0.475278 0.341660 O\n0.647578 0.024722 0.658340 O\n0.852422 0.524722 0.841660 O\n0.147578 0.024722 0.841660 O\n0.352422 0.524722 0.658340 O\n0.352422 0.975278 0.341660 O\n0.147578 0.475278 0.158340 O\n0.775707 0.500997 0.101266 O\n0.724293 0.000997 0.398734 O\n0.724293 0.499003 0.601266 O\n0.775707 0.999003 0.898734 O\n0.224293 0.499003 0.898734 O\n0.275707 0.999003 0.601266 O\n0.275707 0.500997 0.398734 O\n0.224293 0.000997 0.101266 O\n0.660624 0.933343 0.319049 O\n0.839376 0.433343 0.180951 O\n0.839376 0.066657 0.819049 O\n0.660624 0.566657 0.680951 O\n0.339376 0.066657 0.680951 O\n0.160624 0.566657 0.819049 O\n0.160624 0.933343 0.180951 O\n0.339376 0.433343 0.319049 O\n0.833470 0.941484 0.451959 O\n0.666530 0.441484 0.048041 O\n0.666530 0.058516 0.951959 O\n0.833470 0.558516 0.548041 O\n0.166530 0.058516 0.548041 O\n0.333470 0.558516 0.951959 O\n0.333470 0.941484 0.048041 O\n0.166530 0.441484 0.451959 O\n0.009786 0.727817 0.400931 O\n0.490214 0.227817 0.099069 O\n0.490214 0.272183 0.900931 O\n0.009786 0.772183 0.599069 O\n0.990214 0.272183 0.599069 O\n0.509786 0.772183 0.900931 O\n0.509786 0.727817 0.099069 O\n0.990214 0.227817 0.400931 O\n0.614602 0.575555 0.300820 O\n0.885398 0.075555 0.199180 O\n0.885398 0.424445 0.800820 O\n0.614602 0.924445 0.699180 O\n0.385398 0.424445 0.699180 O\n0.114602 0.924445 0.800820 O\n0.114602 0.575555 0.199180 O\n0.385398 0.075555 0.300820 O\n",
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{
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{
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