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{
"id": "mp-1093679",
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"structure_string": "Ti1 Ga1 Cu2\n1.0\n-4.846629 4.982710 6.818063\n4.846629 -4.982710 6.818063\n4.846629 4.982710 -6.818063\nTi Ga Cu\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.000000 0.500000 Ga\n0.256558 0.000000 0.256558 Cu\n0.743442 0.000000 0.743442 Cu\n",
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{
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{
"id": "mp-1097157",
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{
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"created_at": "2022-09-04T14:40:05.229909Z",
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{
"id": "mp-1097455",
"created_at": "2022-09-04T14:48:05.698912Z",
"structure_string": "Ti1 Mn2 Nb1\n1.0\n-4.747861 4.863122 7.293493\n4.747861 -4.863122 7.293493\n4.747861 4.863122 -7.293493\nTi Mn Nb\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.000000 0.257561 0.257561 Mn\n0.000000 0.742439 0.742439 Mn\n0.000000 0.500000 0.500000 Nb\n",
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"formula_full": "Ti1 Mn2 Nb1",
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{
"id": "mp-569787",
"created_at": "2022-09-04T14:41:05.949300Z",
"structure_string": "Al4 B12 H48\n1.0\n6.376631 0.000000 0.000000\n0.000000 6.472262 0.000000\n0.000000 0.000000 18.611540\nAl B H\n4 12 48\ndirect\n0.790431 0.844286 0.870295 Al\n0.290431 0.155714 0.129705 Al\n0.790431 0.655714 0.370295 Al\n0.290431 0.344286 0.629705 Al\n0.515285 0.518899 0.416554 B\n0.936254 0.506057 0.280234 B\n0.015285 0.481101 0.583446 B\n0.515285 0.981101 0.916554 B\n0.015285 0.018899 0.083446 B\n0.936254 0.993943 0.780234 B\n0.427352 0.434135 0.088532 B\n0.927352 0.565865 0.911468 B\n0.927352 0.934135 0.411468 B\n0.427352 0.065865 0.588532 B\n0.436254 0.006057 0.219766 B\n0.436254 0.493943 0.719766 B\n0.011027 0.165537 0.128697 H\n0.083624 0.000373 0.383828 H\n0.201008 0.974932 0.064645 H\n0.479064 0.534334 0.654764 H\n0.867307 0.348985 0.255332 H\n0.701008 0.025068 0.935355 H\n0.789319 0.862312 0.774895 H\n0.011027 0.334463 0.628697 H\n0.289319 0.362312 0.725105 H\n0.348249 0.521032 0.038427 H\n0.367307 0.651015 0.744668 H\n0.445649 0.131235 0.887088 H\n0.933077 0.086741 0.030401 H\n0.583624 0.999627 0.616172 H\n0.589796 0.085715 0.244842 H\n0.945650 0.868765 0.112912 H\n0.089796 0.585715 0.255158 H\n0.945650 0.631235 0.612912 H\n0.348249 0.978968 0.538427 H\n0.848249 0.021032 0.461573 H\n0.583624 0.500373 0.116172 H\n0.367307 0.848985 0.244668 H\n0.479064 0.965666 0.154764 H\n0.089796 0.914285 0.755158 H\n0.289319 0.137688 0.225105 H\n0.472384 0.246200 0.566223 H\n0.472384 0.253800 0.066223 H\n0.589796 0.414285 0.744842 H\n0.445649 0.368765 0.387088 H\n0.433077 0.913259 0.969599 H\n0.701008 0.474932 0.435355 H\n0.933077 0.413259 0.530401 H\n0.433077 0.586741 0.469599 H\n0.979064 0.034334 0.845236 H\n0.848249 0.478968 0.961573 H\n0.867307 0.151015 0.755332 H\n0.972384 0.753800 0.433777 H\n0.511027 0.834463 0.871303 H\n0.789319 0.637688 0.274895 H\n0.511027 0.665537 0.371303 H\n0.788475 0.928915 0.362471 H\n0.288475 0.428915 0.137529 H\n0.979064 0.465666 0.345236 H\n0.788475 0.571085 0.862471 H\n0.201008 0.525068 0.564645 H\n0.083624 0.499627 0.883828 H\n0.288475 0.071085 0.637529 H\n0.972384 0.746200 0.933777 H\n",
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"formula_full": "Al4 B12 H48",
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"spacegroup": 33
},
{
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"created_at": "2022-09-04T14:48:28.905341Z",
"structure_string": "Mn1 C6 O6\n1.0\n-4.709311 -8.156765 0.013820\n2.106108 -6.653805 0.006910\n-2.369316 -4.103776 12.347575\nMn C O\n1 6 6\ndirect\n0.000000 0.000000 0.000000 Mn\n0.686818 0.000000 0.503741 C\n0.313182 0.000000 0.496259 C\n0.684448 0.230581 0.003115 C\n0.315552 0.769419 0.996885 C\n0.915029 0.769419 0.003115 C\n0.084971 0.230581 0.996885 C\n0.572238 0.228544 0.503679 O\n0.427762 0.771456 0.496321 O\n0.734376 0.000000 0.997844 O\n0.199217 0.228544 0.496321 O\n0.265624 0.000000 0.002156 O\n0.800783 0.771456 0.503679 O\n",
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{
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{
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{
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{
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"structure_string": "Mg1 Sc1 Tl2\n1.0\n-5.864122 6.193583 8.808554\n5.864122 -6.193583 8.808554\n5.864122 6.193583 -8.808554\nMg Sc Tl\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.000000 0.500000 0.500000 Sc\n0.000000 0.250035 0.250035 Tl\n0.000000 0.749965 0.749965 Tl\n",
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{
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]
}