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{
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{
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"structure_string": "Ba4 Bi1 Pb3 O12\n1.0\n4.352488 0.000000 0.000000\n0.000000 4.352488 0.000000\n-0.000000 -0.000000 17.440280\nBa Bi Pb O\n4 1 3 12\ndirect\n0.500000 0.500000 0.869680 Ba\n0.500000 0.500000 0.623118 Ba\n0.500000 0.500000 0.376882 Ba\n0.500000 0.500000 0.130320 Ba\n0.000000 0.000000 0.000000 Bi\n0.000000 0.000000 0.749082 Pb\n0.000000 0.000000 0.500000 Pb\n0.000000 0.000000 0.250918 Pb\n0.000000 0.000000 0.625444 O\n0.000000 0.000000 0.876256 O\n0.500000 -0.000000 -0.000000 O\n0.500000 -0.000000 0.246374 O\n0.500000 -0.000000 0.500000 O\n-0.000000 0.500000 0.500000 O\n-0.000000 0.500000 -0.000000 O\n-0.000000 0.500000 0.246374 O\n0.000000 0.000000 0.374556 O\n-0.000000 0.500000 0.753626 O\n0.500000 -0.000000 0.753626 O\n0.000000 0.000000 0.123744 O\n",
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{
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"structure_string": "Sn2 H8 C4 Cl4\n1.0\n5.343205 0.011042 -0.098149\n-2.603094 4.951305 -1.036517\n0.014660 0.092378 9.948772\nSn H C Cl\n2 8 4 4\ndirect\n0.969895 0.866461 0.717730 Sn\n0.059911 0.042203 0.230386 Sn\n0.700782 0.901481 0.422785 H\n0.790912 0.133576 0.024441 H\n0.281368 -0.000064 0.950586 H\n0.322138 0.077826 0.535419 H\n0.072541 0.737013 0.462185 H\n0.738753 0.792948 0.997089 H\n0.249513 0.293820 0.931258 H\n0.974178 0.240762 0.481964 H\n0.928904 0.033209 0.438150 C\n0.096858 0.934454 0.513194 C\n0.896066 0.006587 0.020428 C\n0.133347 0.077954 0.930384 C\n0.202919 0.687943 0.173595 Cl\n0.554642 0.369544 0.279824 Cl\n0.815088 0.405441 0.751299 Cl\n0.464519 0.733164 0.687005 Cl\n",
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{
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"updated_at": "2022-09-04T14:38:34.820261Z",
"structure_string": "Te2 Mo3 W1 Se6\n1.0\n3.384755 0.000070 -0.006017\n-1.692316 2.931435 0.014251\n-0.060945 0.131375 33.553630\nTe Mo W Se\n2 3 1 6\ndirect\n0.333900 0.661579 0.733063 Te\n0.334919 0.672203 0.620809 Te\n0.333775 0.664103 0.080340 Mo\n0.666010 0.335225 0.275505 Mo\n0.667739 0.333532 0.676989 Mo\n0.332470 0.667125 0.470089 W\n0.332238 0.664115 0.324797 Se\n0.667550 0.335315 0.031076 Se\n0.666302 0.338395 0.420576 Se\n0.666660 0.326191 0.129649 Se\n0.665313 0.329190 0.519655 Se\n0.333118 0.673024 0.226200 Se\n",
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{
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"structure_string": "Ce4 Ni2 Sn4 Pt2\n1.0\n4.590813 0.000000 0.000000\n0.000000 7.391491 0.000000\n0.000000 -0.000000 7.907453\nCe Ni Sn Pt\n4 2 4 2\ndirect\n0.500000 0.481703 0.550737 Ce\n0.500000 0.981703 0.449263 Ce\n-0.000000 0.510949 0.950293 Ce\n-0.000000 0.010949 0.049707 Ce\n-0.000000 0.798700 0.663617 Ni\n-0.000000 0.298700 0.336382 Ni\n0.500000 0.311375 0.175952 Sn\n0.500000 0.811375 0.824047 Sn\n-0.000000 0.676841 0.347590 Sn\n-0.000000 0.176841 0.652410 Sn\n0.500000 0.220431 0.838963 Pt\n0.500000 0.720431 0.161037 Pt\n",
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"structure_string": "Mo2 W2 Se6 S2\n1.0\n3.291174 0.000000 0.000000\n-1.645587 2.850241 -0.000017\n-0.000002 -0.000203 35.002443\nMo W Se S\n2 2 6 2\ndirect\n0.333341 0.666682 0.468623 Mo\n0.666664 0.333331 0.279574 Mo\n0.333323 0.666649 0.096597 W\n0.666668 0.333338 0.658127 W\n0.333330 0.666663 0.327745 Se\n0.333339 0.666680 0.706527 Se\n0.666671 0.333342 0.420447 Se\n0.666677 0.333354 0.516791 Se\n0.333333 0.666668 0.231414 Se\n0.333332 0.666665 0.609664 Se\n0.666649 0.333300 0.052560 S\n0.666664 0.333330 0.140677 S\n",
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"structure_string": "Li3 V3 Co1 O8\n1.0\n3.263798 -0.020614 9.716512\n-1.675910 2.867215 9.698101\n-0.059193 -0.004103 14.555426\nLi V Co O\n3 3 1 8\ndirect\n-0.000061 0.506681 0.496798 Li\n0.506612 0.000039 0.496798 Li\n0.493150 0.493415 0.510183 Li\n0.000022 0.519710 0.987242 V\n0.519762 -0.000002 0.987196 V\n0.480284 0.480252 0.026679 V\n0.000037 -0.000012 -0.001613 Co\n-0.000027 0.000007 0.258933 O\n-0.000034 0.508203 0.252462 O\n0.508166 0.000004 0.252467 O\n0.000061 -0.000009 0.750445 O\n0.491809 0.491818 0.268829 O\n0.000079 0.492868 0.742583 O\n0.492974 -0.000045 0.742599 O\n0.507184 0.507091 0.728370 O\n",
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"structure_string": "Cd1 H18 C11 O4\n1.0\n3.858700 -0.028515 0.387548\n1.640046 4.159224 0.499010\n0.177804 -0.021064 16.977612\nCd H C O\n1 18 11 4\ndirect\n0.117390 -0.019451 0.847087 Cd\n0.694000 0.683653 0.501603 H\n0.677231 0.178666 0.580595 H\n0.350768 0.419378 0.128432 H\n0.813674 0.253939 0.272172 H\n0.326674 0.384420 0.274496 H\n0.760761 0.212801 0.425714 H\n0.275144 0.344789 0.423798 H\n0.209205 0.822677 0.497326 H\n0.838559 0.297600 0.119484 H\n0.823569 0.160673 0.005814 H\n0.396643 0.980175 0.047915 H\n0.799780 0.765565 0.191856 H\n0.311468 0.901229 0.196674 H\n0.761645 0.722988 0.347153 H\n0.274708 0.860469 0.347302 H\n0.585799 0.659684 0.656413 H\n0.110279 0.799742 0.644627 H\n0.194783 0.309008 0.573249 H\n0.693648 0.624570 0.972230 C\n0.560373 0.725601 0.045421 C\n0.581120 0.512144 0.121094 C\n0.563765 0.682507 0.195571 C\n0.559366 0.471090 0.272581 C\n0.423984 0.395048 0.576058 C\n0.507226 0.430494 0.424349 C\n0.459429 0.602205 0.499827 C\n0.356908 0.578600 0.650104 C\n0.288060 0.396859 0.727147 C\n0.526121 0.640823 0.347752 C\n0.886882 0.297511 0.961713 O\n0.352850 0.460593 0.794359 O\n0.158174 0.176610 0.722521 O\n0.668644 0.804019 0.904315 O\n",
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{
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{
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"structure_string": "Ba2 Dy1 U1 O6\n1.0\n5.376106 -0.000000 3.103896\n1.792035 5.068641 3.103896\n-0.000000 -0.000000 6.207792\nBa Dy U O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750001 0.750000 0.750000 Ba\n0.500001 0.500000 0.500000 Dy\n0.000000 0.000000 0.000000 U\n0.755011 0.244990 0.244990 O\n0.244991 0.755010 0.755010 O\n0.244991 0.755010 0.244990 O\n0.755011 0.244990 0.755010 O\n0.244991 0.244990 0.755010 O\n0.755011 0.755010 0.244991 O\n",
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