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{
"id": "jvasp-74422",
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"structure_string": "Hf2 Be1 Tc1\n1.0\n-2.277023 2.277023 3.220354\n2.277023 -2.277023 3.220354\n2.277023 2.277023 -3.220354\nHf Be Tc\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Hf\n0.499999 0.499999 0.000000 Hf\n0.749999 0.250000 0.499999 Be\n0.250000 0.749999 0.499999 Tc\n",
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{
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{
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"structure_string": "Ta1 Nb1 As1\n1.0\n-0.000000 3.149377 3.149377\n3.149377 -0.000000 3.149377\n3.149377 3.149377 0.000000\nTa Nb As\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ta\n0.750001 0.750001 0.750001 Nb\n0.500001 0.500001 0.500001 As\n",
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{
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"updated_at": "2022-09-04T14:37:30.354629Z",
"structure_string": "Cr4 N8\n1.0\n0.000000 0.000000 -5.656141\n-1.064671 -6.945417 -2.828070\n-6.994716 0.668056 -2.828070\nCr N\n4 8\ndirect\n0.915110 0.928959 0.239003 Cr\n0.083072 0.071041 0.760998 Cr\n0.583072 0.260997 0.571042 Cr\n0.415110 0.739003 0.428959 Cr\n0.701707 0.797387 0.297060 N\n0.796154 0.202613 0.702941 N\n0.296154 0.202940 0.702613 N\n0.201707 0.797060 0.297387 N\n0.749122 0.125699 0.374301 N\n0.249121 0.874301 0.625699 N\n-0.000585 0.000000 0.000000 N\n0.499415 0.500000 0.500000 N\n",
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{
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"structure_string": "Y1 Be1 Cr4\n1.0\n-0.000000 3.493002 3.493002\n3.493002 0.000000 3.493002\n3.493002 3.493002 0.000000\nY Be Cr\n1 1 4\ndirect\n0.750000 0.750000 0.750000 Y\n0.000000 0.000000 0.000000 Be\n0.373666 0.373666 0.373666 Cr\n0.373666 0.879004 0.373666 Cr\n0.373666 0.373666 0.879004 Cr\n0.879004 0.373666 0.373666 Cr\n",
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{
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"created_at": "2022-09-04T14:37:12.410053Z",
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"structure_string": "Cr3 Fe1\n1.0\n3.562780 0.000000 -0.000000\n0.000000 3.562780 0.000000\n0.000000 0.000000 3.562780\nCr Fe\n3 1\ndirect\n0.000000 0.500000 0.500000 Cr\n0.500000 0.500000 0.000000 Cr\n0.500000 0.000000 0.500000 Cr\n0.000000 0.000000 0.000000 Fe\n",
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{
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"created_at": "2022-09-04T14:37:10.109782Z",
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"structure_string": "Cr3 Fe1\n1.0\n3.562837 0.000000 -0.000000\n0.000000 3.562837 -0.000000\n0.000000 0.000000 3.562837\nCr Fe\n3 1\ndirect\n0.000000 0.500000 0.500000 Cr\n0.500000 0.500000 0.000000 Cr\n0.500000 0.000000 0.500000 Cr\n0.000000 0.000000 0.000000 Fe\n",
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{
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"created_at": "2022-09-04T14:38:38.685596Z",
"updated_at": "2022-09-04T14:38:38.685625Z",
"structure_string": "U3 P2 Se1\n1.0\n5.167420 0.029506 -4.648180\n-0.494720 3.779366 -5.812084\n-0.013762 -0.029506 6.950368\nU P Se\n3 2 1\ndirect\n0.500000 0.000000 0.500000 U\n0.175479 0.675479 0.500001 U\n0.824522 0.324522 0.500001 U\n0.663060 0.663061 0.000002 P\n0.336940 0.336941 0.000001 P\n0.000000 0.000000 0.000000 Se\n",
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{
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"created_at": "2022-09-04T14:37:06.461007Z",
"updated_at": "2022-09-04T14:37:06.461033Z",
"structure_string": "H40 C20 S4\n1.0\n7.398371 0.000000 -2.602618\n0.000000 8.919117 0.000000\n-0.106037 0.000000 7.947053\nH C S\n40 20 4\ndirect\n0.374691 0.123538 0.465145 H\n0.870150 0.631958 0.789784 H\n0.129849 0.368042 0.210215 H\n0.125961 0.123978 0.035309 H\n0.874038 0.876022 0.964690 H\n0.874038 0.623978 0.464691 H\n0.125961 0.376022 0.535308 H\n0.368436 0.126901 0.119289 H\n0.631563 0.873099 0.880711 H\n0.631563 0.626901 0.380711 H\n0.368526 0.886602 0.948853 H\n0.631474 0.113398 0.051146 H\n0.631473 0.386602 0.551146 H\n0.368526 0.613398 0.448853 H\n0.129596 0.887582 0.866794 H\n0.870404 0.112418 0.133205 H\n0.870403 0.387582 0.633205 H\n0.129596 0.612418 0.366794 H\n0.870150 0.868042 0.289784 H\n0.129849 0.131958 0.710215 H\n0.368436 0.373099 0.619288 H\n0.629163 0.631517 0.709788 H\n0.370837 0.368483 0.290212 H\n0.625308 0.876462 0.534854 H\n0.625308 0.623538 0.034855 H\n0.374691 0.376462 0.965145 H\n0.132238 0.127324 0.381106 H\n0.867762 0.627324 0.118893 H\n0.132237 0.372677 0.881106 H\n0.369683 0.887081 0.633165 H\n0.867762 0.872677 0.618893 H\n0.630316 0.387081 0.866834 H\n0.369684 0.612920 0.133166 H\n0.130766 0.887088 0.551089 H\n0.869233 0.112912 0.448910 H\n0.869233 0.387088 0.948910 H\n0.130766 0.612913 0.051090 H\n0.370836 0.131517 0.790211 H\n0.630316 0.112920 0.366834 H\n0.629163 0.868483 0.209788 H\n0.249503 0.538451 0.409329 C\n0.248485 0.053555 0.071173 C\n0.751515 0.946445 0.928827 C\n0.751515 0.553555 0.428827 C\n0.750497 0.461549 0.590670 C\n0.249502 0.961549 0.909329 C\n0.750497 0.038451 0.090670 C\n0.250145 0.441693 0.250148 C\n0.248484 0.446445 0.571172 C\n0.749854 0.558307 0.749851 C\n0.748199 0.553550 0.070882 C\n0.250145 0.058307 0.750148 C\n0.250233 0.538449 0.090777 C\n0.749766 0.461551 0.909222 C\n0.749766 0.038449 0.409222 C\n0.250233 0.961551 0.590777 C\n0.251800 0.446451 0.929117 C\n0.748199 0.946451 0.570882 C\n0.251800 0.053550 0.429118 C\n0.749854 0.941693 0.249851 C\n0.750182 0.424532 0.249966 S\n0.249817 0.924532 0.250034 S\n0.750182 0.075468 0.749965 S\n0.249817 0.575468 0.750034 S\n",
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{
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"structure_string": "K4 Cd2 C8 N8\n1.0\n7.861759 0.000000 4.538988\n2.620586 7.412137 4.538988\n0.000000 0.000000 9.077976\nK Cd C N\n4 2 8 8\ndirect\n0.000000 0.500000 0.500000 K\n0.500000 -0.000000 0.500000 K\n0.500000 0.500000 -0.000000 K\n0.500000 0.500000 0.500000 K\n0.125000 0.125000 0.125000 Cd\n0.875001 0.875000 0.875000 Cd\n0.775456 0.775456 0.173632 C\n0.224545 0.826369 0.224544 C\n0.173632 0.775456 0.775456 C\n0.775456 0.173632 0.775456 C\n0.826369 0.224544 0.224544 C\n0.224544 0.224544 0.826369 C\n0.775456 0.775456 0.775456 C\n0.224544 0.224544 0.224544 C\n0.331400 0.722867 0.722867 N\n0.722867 0.331399 0.722867 N\n0.722867 0.722867 0.722867 N\n0.277133 0.668601 0.277133 N\n0.277133 0.277133 0.668601 N\n0.277133 0.277133 0.277133 N\n0.722867 0.722867 0.331399 N\n0.668601 0.277133 0.277133 N\n",
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{
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}