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{
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{
"id": "jvasp-24284",
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{
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"structure_string": "Mo4 H24 N4 O12 F8\n1.0\n4.277241 6.830653 -1.817842\n-4.277241 6.830653 1.817842\n0.009967 0.000000 7.891781\nMo H N O F\n4 24 4 12 8\ndirect\n0.984886 0.716570 0.739157 Mo\n0.716571 0.984885 0.760843 Mo\n0.015114 0.283429 0.260843 Mo\n0.283429 0.015114 0.239157 Mo\n0.666754 0.751749 0.327416 H\n0.751749 0.666754 0.172584 H\n0.248251 0.333245 0.827416 H\n0.806579 0.076629 0.368703 H\n0.076629 0.806578 0.131297 H\n0.193421 0.923370 0.631297 H\n0.923371 0.193421 0.868703 H\n0.757969 0.133367 0.145248 H\n0.133367 0.757969 0.354752 H\n0.242031 0.866632 0.854752 H\n0.866632 0.242031 0.645248 H\n0.333245 0.248250 0.672584 H\n0.885669 0.706843 0.338702 H\n0.706843 0.885669 0.161298 H\n0.630739 0.528290 0.865647 H\n0.369261 0.471709 0.134353 H\n0.471709 0.369261 0.365647 H\n0.577922 0.407698 0.733353 H\n0.528291 0.630738 0.634353 H\n0.422078 0.592301 0.266647 H\n0.592301 0.422078 0.233353 H\n0.114331 0.293156 0.661298 H\n0.293157 0.114330 0.838702 H\n0.407699 0.577921 0.766647 H\n0.535498 0.535497 0.750000 N\n0.464502 0.464502 0.250000 N\n0.246535 0.246534 0.750000 N\n0.753465 0.753465 0.250000 N\n0.158093 0.811701 0.243478 O\n0.197834 0.048874 0.446096 O\n0.811701 0.158093 0.256522 O\n0.841907 0.188298 0.756522 O\n0.188299 0.841906 0.743478 O\n0.048874 0.197833 0.053904 O\n0.568874 0.888247 0.767485 O\n0.951126 0.802166 0.946096 O\n0.431126 0.111752 0.232515 O\n0.111752 0.431126 0.267485 O\n0.888248 0.568873 0.732515 O\n0.802166 0.951125 0.553904 O\n0.762198 0.491401 0.086613 F\n0.089309 0.662146 0.532530 F\n0.662146 0.089309 0.967470 F\n0.910690 0.337853 0.467470 F\n0.337854 0.910690 0.032530 F\n0.237802 0.508599 0.913387 F\n0.508599 0.237801 0.586613 F\n0.491401 0.762198 0.413387 F\n",
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{
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"structure_string": "Na12 Sc4 Si8 O28\n1.0\n5.371070 0.000000 0.000000\n-0.000000 9.401914 0.000000\n0.000000 0.000000 13.109830\nNa Sc Si O\n12 4 8 28\ndirect\n0.018669 0.348358 0.403725 Na\n0.016496 0.020938 0.250000 Na\n0.981331 0.651642 0.596275 Na\n0.481331 0.848358 0.403725 Na\n0.518669 0.151642 0.903725 Na\n0.018669 0.348358 0.096275 Na\n0.516496 0.479062 0.750000 Na\n0.481331 0.848358 0.096275 Na\n0.983504 0.979061 0.750000 Na\n0.518669 0.151642 0.596275 Na\n0.981331 0.651642 0.903725 Na\n0.483504 0.520938 0.250000 Na\n0.500000 0.500000 0.000000 Sc\n0.000000 0.000000 0.500000 Sc\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 Sc\n0.987152 0.676339 0.131336 Si\n0.987152 0.676339 0.368664 Si\n0.012848 0.323661 0.868664 Si\n0.487152 0.823661 0.631336 Si\n0.512848 0.176339 0.368664 Si\n0.012848 0.323661 0.631336 Si\n0.512848 0.176339 0.131336 Si\n0.487152 0.823661 0.868664 Si\n0.801725 0.131000 0.108132 O\n0.937805 0.378360 0.750000 O\n0.821494 0.409212 0.943176 O\n0.698275 0.631000 0.391868 O\n0.698275 0.631000 0.108132 O\n0.678506 0.909211 0.943176 O\n0.198275 0.869000 0.891868 O\n0.969708 0.152254 0.878710 O\n0.437805 0.121640 0.250000 O\n0.530292 0.652254 0.878710 O\n0.562195 0.878359 0.750000 O\n0.301725 0.369000 0.891868 O\n0.801725 0.131000 0.391868 O\n0.321494 0.090788 0.443176 O\n0.030292 0.847745 0.121290 O\n0.030292 0.847745 0.378710 O\n0.530292 0.652254 0.621290 O\n0.969708 0.152254 0.621290 O\n0.178506 0.590788 0.443176 O\n0.301725 0.369000 0.608132 O\n0.469708 0.347746 0.378710 O\n0.321494 0.090788 0.056824 O\n0.198275 0.869000 0.608132 O\n0.678506 0.909211 0.556824 O\n0.062195 0.621640 0.250000 O\n0.469708 0.347746 0.121290 O\n0.178506 0.590788 0.056824 O\n0.821494 0.409212 0.556824 O\n",
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{
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"created_at": "2022-09-04T14:36:31.688975Z",
"updated_at": "2022-09-04T14:36:31.689008Z",
"structure_string": "H24 C28\n1.0\n4.558809 -0.006984 -0.913764\n-2.362467 8.455260 -0.452774\n-0.051798 -0.116614 11.506458\nH C\n24 28\ndirect\n0.509404 0.230999 0.181626 H\n0.441442 0.451094 0.808903 H\n0.440935 0.451185 0.308911 H\n0.507633 0.984773 0.017264 H\n0.507238 0.985357 0.517484 H\n0.056679 0.597114 0.272299 H\n0.123413 0.130707 0.980673 H\n0.123246 0.130933 0.480613 H\n0.054758 0.350830 0.107969 H\n0.054778 0.351099 0.607897 H\n0.550523 0.797323 0.354851 H\n0.551512 0.796666 0.854624 H\n0.057413 0.596656 0.772061 H\n0.600817 0.504833 0.618868 H\n0.963845 0.077183 0.670679 H\n0.963358 0.077303 0.170643 H\n0.537031 0.605292 0.992699 H\n0.537091 0.605614 0.492657 H\n0.027566 0.976397 0.796890 H\n0.027265 0.976580 0.296869 H\n0.013803 0.784558 0.934711 H\n0.013122 0.785357 0.434926 H\n0.510096 0.230994 0.681608 H\n0.600982 0.504555 0.118918 H\n0.999105 0.676582 0.097541 C\n0.565519 0.905264 0.692023 C\n0.565203 0.905311 0.192026 C\n0.743490 0.417273 0.467362 C\n0.743709 0.417076 0.967396 C\n0.592755 0.381247 0.846790 C\n0.630603 0.257068 0.775338 C\n0.129699 0.787903 0.527578 C\n0.129984 0.787443 0.027465 C\n0.592311 0.381360 0.346782 C\n0.999139 0.676746 0.597522 C\n0.630052 0.257139 0.275338 C\n0.821124 0.164722 0.822183 C\n0.862961 0.030133 0.744212 C\n0.434331 0.794445 0.262100 C\n0.434949 0.794113 0.761969 C\n0.934261 0.324743 0.014238 C\n0.934109 0.324964 0.514188 C\n0.155891 0.681724 0.215737 C\n0.156375 0.681499 0.715598 C\n0.972109 0.200561 0.942787 C\n0.971850 0.200747 0.442742 C\n0.701771 0.551626 0.045370 C\n0.701698 0.551877 0.545333 C\n0.408277 0.900513 0.573948 C\n0.862552 0.030257 0.244194 C\n0.820689 0.164838 0.322162 C\n0.408418 0.900166 0.073828 C\n",
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{
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{
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