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{
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{
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"structure_string": "Cu4 H24 C8 O28\n1.0\n6.589924 0.000000 0.000000\n0.000000 9.600438 0.000000\n0.000000 0.000000 10.337667\nCu H C O\n4 24 8 28\ndirect\n0.500000 0.750000 0.634279 Cu\n0.500000 0.250000 0.865721 Cu\n0.500000 0.250000 0.365721 Cu\n0.500000 0.750000 0.134279 Cu\n0.181930 0.633362 0.770125 H\n0.818070 0.866638 0.770125 H\n0.818070 0.133362 0.729875 H\n0.181930 0.366638 0.729875 H\n0.818070 0.366638 0.229875 H\n0.181930 0.133362 0.229875 H\n0.181930 0.866638 0.270125 H\n0.818070 0.633362 0.270125 H\n0.281970 0.758664 0.854407 H\n0.718030 0.741336 0.854407 H\n0.718030 0.258664 0.645593 H\n0.281970 0.241336 0.645593 H\n0.718030 0.241336 0.145593 H\n0.281970 0.258664 0.145593 H\n0.281970 0.741336 0.354407 H\n0.718030 0.758664 0.354407 H\n0.914677 0.522967 0.678813 H\n0.085323 0.977033 0.678813 H\n0.085323 0.022967 0.821187 H\n0.914677 0.477033 0.821187 H\n0.085323 0.477033 0.321187 H\n0.914677 0.022967 0.321187 H\n0.914677 0.977033 0.178813 H\n0.085323 0.522967 0.178813 H\n0.603222 0.481076 0.529268 C\n0.396778 0.018924 0.529268 C\n0.396778 0.981076 0.970732 C\n0.603222 0.518924 0.970732 C\n0.396778 0.518924 0.470732 C\n0.603222 0.981076 0.470732 C\n0.603222 0.018924 0.029268 C\n0.396778 0.481076 0.029268 C\n0.684715 0.570106 0.602945 O\n0.315285 0.929894 0.602945 O\n0.315285 0.070106 0.897055 O\n0.684715 0.429894 0.897055 O\n0.315285 0.429894 0.397055 O\n0.684715 0.070106 0.397055 O\n0.684715 0.929894 0.102945 O\n0.315285 0.570106 0.102945 O\n0.321192 0.636885 0.499729 O\n0.678808 0.863115 0.499729 O\n0.678808 0.136885 0.000271 O\n0.321192 0.363115 0.000271 O\n0.678808 0.363115 0.500271 O\n0.321192 0.136885 0.500271 O\n0.321192 0.863115 0.999729 O\n0.678808 0.636885 0.999729 O\n0.305097 0.692424 0.782911 O\n0.694903 0.807576 0.782911 O\n0.694903 0.192424 0.717089 O\n0.305097 0.307576 0.717089 O\n0.694903 0.307576 0.217089 O\n0.305097 0.192424 0.217089 O\n0.305097 0.807576 0.282911 O\n0.694903 0.692424 0.282911 O\n0.010729 0.500000 0.750000 O\n0.989271 0.000000 0.750000 O\n0.989271 0.500000 0.250000 O\n0.010729 0.000000 0.250000 O\n",
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{
"id": "mp-1191296",
"created_at": "2022-09-04T14:39:05.704318Z",
"structure_string": "Zn5 N2 O16\n1.0\n3.072580 9.591436 0.000000\n-3.072580 9.591436 0.000000\n0.000000 0.388594 5.323611\nZn N O\n5 2 16\ndirect\n0.500000 0.500000 0.000000 Zn\n0.756950 0.243050 0.500000 Zn\n0.243050 0.756950 0.500000 Zn\n0.093723 0.093723 0.983095 Zn\n0.906277 0.906277 0.016905 Zn\n0.722018 0.722018 0.499184 N\n0.277982 0.277982 0.500816 N\n0.803627 0.304967 0.821691 O\n0.304967 0.803627 0.821691 O\n0.196373 0.695033 0.178309 O\n0.695033 0.196373 0.178309 O\n0.944209 0.944209 0.665952 O\n0.055791 0.055791 0.334048 O\n0.451690 0.451690 0.677364 O\n0.548310 0.548310 0.322636 O\n0.787672 0.787672 0.500803 O\n0.212328 0.212328 0.499197 O\n0.684103 0.684103 0.700188 O\n0.315897 0.315897 0.299812 O\n0.305843 0.305843 0.707453 O\n0.694157 0.694157 0.292547 O\n0.808617 0.808617 0.995332 O\n0.191383 0.191383 0.004668 O\n",
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{
"id": "mp-8022",
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"structure_string": "Al2 O1\n1.0\n0.000000 2.845710 2.845710\n2.845710 0.000000 2.845710\n2.845710 2.845710 0.000000\nAl O\n2 1\ndirect\n0.250000 0.250000 0.250000 Al\n0.750000 0.750000 0.750000 Al\n0.000000 0.000000 0.000000 O\n",
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{
"id": "mp-1201604",
"created_at": "2022-09-04T14:39:07.288087Z",
"structure_string": "Cd16 B8 O32\n1.0\n0.000000 7.072445 7.072445\n7.072445 0.000000 7.072445\n7.072445 7.072445 0.000000\nCd B O\n16 8 32\ndirect\n0.045400 0.454600 0.045400 Cd\n0.454600 0.045400 0.454600 Cd\n0.204600 0.795400 0.204600 Cd\n0.795400 0.204600 0.795400 Cd\n0.045400 0.045400 0.454600 Cd\n0.454600 0.454600 0.045400 Cd\n0.204600 0.204600 0.795400 Cd\n0.795400 0.795400 0.204600 Cd\n0.454600 0.045400 0.045400 Cd\n0.045400 0.454600 0.454600 Cd\n0.795400 0.204600 0.204600 Cd\n0.204600 0.795400 0.795400 Cd\n0.125000 0.625000 0.625000 Cd\n0.625000 0.125000 0.625000 Cd\n0.625000 0.625000 0.125000 Cd\n0.625000 0.625000 0.625000 Cd\n0.442688 0.852437 0.852437 B\n0.852437 0.442688 0.852437 B\n0.852437 0.852437 0.442688 B\n0.852437 0.852437 0.852437 B\n0.807312 0.397563 0.397563 B\n0.397563 0.807312 0.397563 B\n0.397563 0.397563 0.807312 B\n0.397563 0.397563 0.397563 B\n0.994879 0.717456 0.847425 O\n0.717456 0.994879 0.440241 O\n0.847425 0.440241 0.994879 O\n0.440241 0.847425 0.717456 O\n0.255121 0.532544 0.402575 O\n0.532544 0.255121 0.809759 O\n0.402575 0.809759 0.255121 O\n0.809759 0.402575 0.532544 O\n0.847425 0.994879 0.717456 O\n0.440241 0.717456 0.994879 O\n0.994879 0.847425 0.440241 O\n0.717456 0.440241 0.847425 O\n0.402575 0.255121 0.532544 O\n0.809759 0.532544 0.255121 O\n0.255121 0.402575 0.809759 O\n0.532544 0.809759 0.402575 O\n0.717456 0.847425 0.994879 O\n0.994879 0.440241 0.717456 O\n0.440241 0.994879 0.847425 O\n0.847425 0.717456 0.440241 O\n0.532544 0.402575 0.255121 O\n0.255121 0.809759 0.532544 O\n0.809759 0.255121 0.402575 O\n0.402575 0.532544 0.809759 O\n0.532015 0.155995 0.155995 O\n0.155995 0.532015 0.155995 O\n0.155995 0.155995 0.532015 O\n0.155995 0.155995 0.155995 O\n0.717985 0.094005 0.094005 O\n0.094005 0.717985 0.094005 O\n0.094005 0.094005 0.717985 O\n0.094005 0.094005 0.094005 O\n",
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{
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{
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"structure_string": "Yb4 Ni4 Sn4\n1.0\n4.451372 0.000000 0.000000\n0.000000 7.162295 0.000000\n0.000000 0.000000 7.631562\nYb Ni Sn\n4 4 4\ndirect\n0.250000 0.975462 0.815764 Yb\n0.750000 0.024538 0.184236 Yb\n0.250000 0.475462 0.684236 Yb\n0.750000 0.524538 0.315764 Yb\n0.750000 0.293805 0.895718 Ni\n0.250000 0.206195 0.395718 Ni\n0.750000 0.793805 0.604282 Ni\n0.250000 0.706195 0.104282 Ni\n0.250000 0.832234 0.423970 Sn\n0.750000 0.667766 0.923970 Sn\n0.250000 0.332234 0.076030 Sn\n0.750000 0.167766 0.576030 Sn\n",
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{
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{
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