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{
"id": "jvasp-107608",
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"structure_string": "K2 Ag1 Sb1 F6\n1.0\n5.577775 -0.000000 3.220330\n1.859258 5.258777 3.220330\n-0.000000 -0.000000 6.440660\nK Ag Sb F\n2 1 1 6\ndirect\n0.750001 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 Sb\n0.739425 0.739424 0.260575 F\n0.739425 0.260576 0.260576 F\n0.260576 0.260576 0.739424 F\n0.739425 0.260576 0.739424 F\n0.260576 0.739424 0.260576 F\n0.260576 0.739424 0.739424 F\n",
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{
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"structure_string": "Sr3 B3 P3 O15\n1.0\n3.441639 -5.961093 0.000000\n3.441639 5.961093 -0.000000\n0.000000 0.000000 6.857818\nSr B P O\n3 3 3 15\ndirect\n0.000000 0.605448 0.166667 Sr\n0.605448 0.000000 0.833333 Sr\n0.394552 0.394552 0.500000 Sr\n0.900748 0.900748 0.500000 B\n0.000000 0.099252 0.166667 B\n0.099252 0.000000 0.833333 B\n0.000000 0.593479 0.666667 P\n0.593479 0.000000 0.333333 P\n0.406521 0.406521 0.000000 P\n0.588239 0.450970 0.146481 O\n0.187867 0.338540 0.127597 O\n0.661460 0.849327 0.460930 O\n0.150673 0.812133 0.794264 O\n0.849327 0.661460 0.539070 O\n0.812133 0.150673 0.205737 O\n0.044044 0.000000 0.333333 O\n0.137269 0.549030 0.520185 O\n0.411762 0.862731 0.186852 O\n0.450970 0.588239 0.853519 O\n0.549030 0.137269 0.479815 O\n0.955956 0.955956 0.000000 O\n0.000000 0.044044 0.666667 O\n0.338540 0.187867 0.872403 O\n0.862731 0.411762 0.813148 O\n",
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{
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"created_at": "2022-09-04T14:37:19.419455Z",
"updated_at": "2022-09-04T14:37:19.419472Z",
"structure_string": "Mg2 Co2 F10\n1.0\n4.778962 0.038104 -1.829544\n-1.953994 4.685991 -0.640744\n-0.141673 -0.020441 7.166424\nMg Co F\n2 2 10\ndirect\n0.284359 0.534358 0.750000 Mg\n0.715641 0.465641 0.250000 Mg\n0.000000 0.000000 0.000000 Co\n0.500000 -0.000000 0.500000 Co\n0.351385 0.101385 0.250000 F\n0.648616 0.898615 0.750001 F\n0.570643 0.717480 0.368125 F\n0.849355 0.202518 0.131876 F\n0.753821 0.674899 0.033023 F\n0.141878 0.720799 0.466978 F\n0.246180 0.325100 0.966977 F\n0.858123 0.279200 0.533023 F\n0.150646 0.797482 0.868124 F\n0.429358 0.282519 0.631876 F\n",
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{
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"created_at": "2022-09-04T14:37:17.282655Z",
"updated_at": "2022-09-04T14:37:17.282672Z",
"structure_string": "Mg2 Ti3 O8\n1.0\n4.731643 -0.004986 -1.487113\n-0.873803 5.193332 -2.797649\n-0.093050 -0.211278 5.992391\nMg Ti O\n2 3 8\ndirect\n0.652864 0.723713 0.447427 Mg\n0.347134 0.276287 0.552573 Mg\n0.500000 0.999998 -0.000000 Ti\n0.999999 0.732869 -0.000000 Ti\n0.999998 0.267129 -0.000000 Ti\n0.079937 0.394028 0.788057 O\n0.920063 0.605969 0.211942 O\n0.080547 0.891515 0.783031 O\n0.919453 0.108483 0.216968 O\n0.406507 0.341596 0.231200 O\n0.406507 0.889603 0.231200 O\n0.593493 0.110395 0.768800 O\n0.593494 0.658403 0.768799 O\n",
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{
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"created_at": "2022-09-04T14:38:05.177639Z",
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"structure_string": "Mg4 Si2 O8\n1.0\n2.832748 0.000000 0.000000\n0.000000 5.021002 -0.000000\n0.000000 0.000000 8.861941\nMg Si O\n4 2 8\ndirect\n0.500000 0.437137 0.816172 Mg\n0.500000 0.562862 0.183828 Mg\n0.500000 0.937137 0.683828 Mg\n0.500000 0.062863 0.316172 Mg\n0.000000 0.500000 0.500000 Si\n0.000000 0.000000 0.000000 Si\n0.000000 0.139756 0.816773 O\n0.000000 0.860244 0.183227 O\n0.000000 0.639756 0.683227 O\n0.000000 0.360244 0.316773 O\n0.500000 0.274408 0.550314 O\n0.500000 0.725591 0.449686 O\n0.500000 0.225591 0.050314 O\n0.500000 0.774408 0.949686 O\n",
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"spacegroup": 55
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{
"id": "jvasp-85272",
"created_at": "2022-09-04T14:35:55.304325Z",
"updated_at": "2022-09-04T14:35:55.304356Z",
"structure_string": "C3 N4\n1.0\n3.454925 0.000000 0.000000\n0.000000 3.454925 0.000000\n0.000000 -0.000000 3.454924\nC N\n3 4\ndirect\n0.000000 0.000000 0.000000 C\n0.500001 0.000000 0.499999 C\n0.000000 0.500001 0.499999 C\n0.244894 0.244894 0.255106 N\n0.755107 0.755107 0.255106 N\n0.244894 0.755107 0.744892 N\n0.755107 0.244894 0.744892 N\n",
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{
"id": "jvasp-36489",
"created_at": "2022-09-04T14:37:09.417703Z",
"updated_at": "2022-09-04T14:37:09.417725Z",
"structure_string": "Sr3 Sb1 P1\n1.0\n5.710137 0.000000 0.000000\n0.000000 5.710137 0.000000\n-0.000000 0.000000 5.710137\nSr Sb P\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Sr\n0.500000 0.000000 0.500000 Sr\n0.500000 0.500000 0.000000 Sr\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 P\n",
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{
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"structure_string": "Ba3 Na3 P3\n1.0\n3.978060 -6.890202 0.000000\n3.978060 6.890202 0.000000\n0.000000 0.000000 4.690300\nBa Na P\n3 3 3\ndirect\n0.412697 0.412697 0.500000 Ba\n0.000000 0.587303 0.500000 Ba\n0.587303 0.000000 0.500000 Ba\n0.000000 0.242318 0.000000 Na\n0.242318 0.000000 0.000000 Na\n0.757682 0.757682 0.000000 Na\n0.666667 0.333333 0.000000 P\n0.000000 0.000000 0.500000 P\n0.333333 0.666667 0.000000 P\n",
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{
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"created_at": "2022-09-04T14:36:08.869892Z",
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"structure_string": "Li4 Mn3 O1 F8\n1.0\n-0.000000 2.947873 -0.000000\n-4.852173 1.473936 0.000465\n-2.398014 0.000000 11.294763\nLi Mn O F\n4 3 1 8\ndirect\n0.140863 0.718278 0.548113 Li\n0.768765 0.462470 0.126860 Li\n0.861305 0.277387 0.442387 Li\n-0.002542 0.005083 0.006665 Li\n0.561155 0.877690 0.289543 Mn\n0.243374 0.513252 0.880798 Mn\n0.426043 0.147914 0.718781 Mn\n0.871662 0.256676 0.836446 O\n0.626961 0.746079 0.962699 F\n0.091602 0.816796 0.708368 F\n0.128550 0.742903 0.166610 F\n0.200193 0.599614 0.394011 F\n0.802500 0.395000 0.593795 F\n0.900330 0.199339 0.278607 F\n0.375284 0.249433 0.063230 F\n0.503963 0.992077 0.483083 F\n",
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"structure_string": "Sr8 B8 O20\n1.0\n0.000000 7.767284 0.085702\n5.372750 0.000000 0.000000\n0.000000 -0.555701 -11.896733\nSr B O\n8 8 20\ndirect\n0.118593 0.953859 0.868033 Sr\n0.881407 0.453859 0.631967 Sr\n0.881407 0.046141 0.131967 Sr\n0.118593 0.546141 0.368033 Sr\n0.624100 0.910864 0.839622 Sr\n0.375900 0.410864 0.660378 Sr\n0.375900 0.089136 0.160378 Sr\n0.624100 0.589136 0.339622 Sr\n0.659330 0.930555 0.594605 B\n0.340669 0.430555 0.905395 B\n0.340669 0.069445 0.405395 B\n0.659330 0.569445 0.094605 B\n0.159575 0.546060 0.084140 B\n0.159575 0.953940 0.584140 B\n0.840424 0.453940 0.915860 B\n0.840424 0.046060 0.415860 B\n0.097574 0.095430 0.668374 O\n0.252202 0.397471 0.006186 O\n0.747798 0.897471 0.493814 O\n0.854397 0.202046 0.927587 O\n0.145603 0.702046 0.572413 O\n0.145603 0.797954 0.072413 O\n0.854397 0.297954 0.427587 O\n0.902425 0.595430 0.831626 O\n0.097574 0.404570 0.168374 O\n0.643219 0.347006 0.146946 O\n0.605488 0.713055 0.640763 O\n0.394512 0.213055 0.859237 O\n0.394512 0.286945 0.359237 O\n0.605488 0.786945 0.140763 O\n0.356781 0.652994 0.853054 O\n0.643219 0.152994 0.646946 O\n0.252202 0.102529 0.506186 O\n0.356781 0.847006 0.353054 O\n0.902425 0.904570 0.331626 O\n0.747798 0.602529 0.993814 O\n",
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{
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"structure_string": "Sr4 Sn2 S8\n1.0\n6.325211 0.013753 -0.000000\n-2.132349 5.954962 -0.000000\n0.000000 -0.000000 10.037691\nSr Sn S\n4 2 8\ndirect\n0.207022 0.207022 0.500000 Sr\n0.207022 0.207022 0.000000 Sr\n0.859830 0.477250 0.250000 Sr\n0.477251 0.859830 0.750000 Sr\n0.459782 0.902551 0.250000 Sn\n0.902551 0.459782 0.750000 Sn\n0.648817 0.100203 0.446550 S\n0.100203 0.648817 0.553450 S\n0.648817 0.100203 0.053450 S\n0.100203 0.648817 0.946550 S\n0.383825 0.501996 0.250000 S\n0.501996 0.383825 0.750000 S\n0.952757 0.091181 0.750000 S\n0.091181 0.952757 0.250000 S\n",
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}
]
}