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{
"id": "mp-1228634",
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{
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{
"id": "mp-1210696",
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"structure_string": "Mo6 N2 O18\n1.0\n0.000000 0.000000 -3.638725\n-5.583533 -9.670963 0.000000\n-5.583533 9.670963 0.000000\nMo N O\n6 2 18\ndirect\n0.750000 0.890821 0.350981 Mo\n0.250000 0.109179 0.649019 Mo\n0.750000 0.460160 0.109179 Mo\n0.250000 0.539840 0.890821 Mo\n0.750000 0.649019 0.539840 Mo\n0.250000 0.350981 0.460160 Mo\n0.750000 0.000000 0.000000 N\n0.250000 0.000000 0.000000 N\n0.750000 0.718596 0.217749 O\n0.250000 0.281404 0.782251 O\n0.750000 0.499152 0.281404 O\n0.250000 0.500848 0.718596 O\n0.750000 0.782251 0.500848 O\n0.250000 0.217749 0.499152 O\n0.750000 0.424898 0.502651 O\n0.250000 0.575102 0.497349 O\n0.750000 0.077753 0.575102 O\n0.250000 0.922247 0.424898 O\n0.750000 0.497349 0.922247 O\n0.250000 0.502651 0.077753 O\n0.750000 0.983848 0.268075 O\n0.250000 0.016152 0.731925 O\n0.750000 0.284227 0.016152 O\n0.250000 0.715773 0.983848 O\n0.750000 0.731925 0.715773 O\n0.250000 0.268075 0.284227 O\n",
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"formula_full": "Mo6 N2 O18",
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"updated_at": "2021-11-28T01:34:30.232000Z",
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},
{
"id": "mp-861607",
"created_at": "2022-09-04T14:39:45.461767Z",
"structure_string": "K2 Na2 Nd2 Ta2 O10\n1.0\n5.792210 0.000000 0.000000\n0.000000 5.792210 0.000000\n0.000000 0.000000 8.337723\nK Na Nd Ta O\n2 2 2 2 10\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.000000 K\n0.000000 0.500000 0.240720 Na\n0.500000 0.000000 0.759280 Na\n0.000000 0.000000 0.500000 Nd\n0.500000 0.500000 0.500000 Nd\n0.500000 0.000000 0.257344 Ta\n0.000000 0.500000 0.742656 Ta\n0.500000 0.000000 0.034437 O\n0.270005 0.770005 0.328523 O\n0.729995 0.770005 0.328523 O\n0.270005 0.229995 0.328523 O\n0.729995 0.229995 0.328523 O\n0.770005 0.270005 0.671477 O\n0.229995 0.270005 0.671477 O\n0.770005 0.729995 0.671477 O\n0.229995 0.729995 0.671477 O\n0.000000 0.500000 0.965563 O\n",
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"formula_full": "K2 Na2 Nd2 Ta2 O10",
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{
"id": "mp-770941",
"created_at": "2022-09-04T14:45:56.439524Z",
"structure_string": "Li4 Mn3 Nb2 Fe3 O16\n1.0\n2.975035 5.257677 0.000000\n-2.975035 5.257677 0.000000\n0.000000 0.382794 9.812529\nLi Mn Nb Fe O\n4 3 2 3 16\ndirect\n0.662849 0.662849 0.096333 Li\n0.995896 0.995896 0.010140 Li\n0.001771 0.001771 0.510874 Li\n0.335309 0.335309 0.597639 Li\n0.829747 0.829747 0.788566 Mn\n0.170209 0.661586 0.285689 Mn\n0.661586 0.170209 0.285689 Mn\n0.668120 0.668120 0.508332 Nb\n0.321310 0.321310 0.006148 Nb\n0.340685 0.830921 0.782200 Fe\n0.830921 0.340685 0.782200 Fe\n0.171132 0.171132 0.282559 Fe\n0.343048 0.845695 0.412186 O\n0.519901 0.519901 0.656532 O\n0.668315 0.668315 0.888910 O\n0.995348 0.995348 0.697755 O\n0.001392 0.001392 0.197212 O\n0.845695 0.343048 0.412186 O\n0.514976 0.965146 0.654625 O\n0.965146 0.514976 0.654625 O\n0.165324 0.165324 0.902970 O\n0.840919 0.840919 0.406523 O\n0.031593 0.472892 0.150173 O\n0.472892 0.031593 0.150173 O\n0.334989 0.334989 0.386904 O\n0.173357 0.664130 0.911500 O\n0.478219 0.478219 0.162182 O\n0.664130 0.173357 0.911500 O\n",
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"formula_full": "Li4 Mn3 Nb2 Fe3 O16",
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{
"id": "mp-1520379",
"created_at": "2022-09-04T14:39:07.112153Z",
"structure_string": "Sr1 Ca1 Y1 V1 O6\n1.0\n-0.000000 -4.092032 -4.092032\n4.092032 0.000000 -4.092032\n4.092032 -4.092032 -0.000000\nSr Ca Y V O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Ca\n0.500000 0.500000 0.500000 Y\n-0.000000 -0.000000 -0.000000 V\n0.768750 0.231250 0.231250 O\n0.231250 0.768750 0.768750 O\n0.768750 0.231250 0.768750 O\n0.231250 0.768750 0.231250 O\n0.768750 0.768750 0.231250 O\n0.231250 0.231250 0.768750 O\n",
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],
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"formula_full": "Sr1 Ca1 Y1 V1 O6",
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{
"id": "mp-773075",
"created_at": "2022-09-04T14:45:22.573792Z",
"structure_string": "Li8 V8 Si24 O60\n1.0\n7.326461 -8.839434 0.000000\n7.326461 8.839434 0.000000\n0.000000 0.000000 10.349816\nLi V Si O\n8 8 24 60\ndirect\n0.996535 0.503465 0.250000 Li\n0.503465 0.996535 0.750000 Li\n0.395325 0.604675 0.744437 Li\n0.895325 0.104675 0.755563 Li\n0.604675 0.395325 0.255563 Li\n0.104675 0.895325 0.244437 Li\n0.496535 0.003465 0.250000 Li\n0.003465 0.496535 0.750000 Li\n0.241336 0.241336 0.000000 V\n0.340675 0.159325 0.250000 V\n0.159325 0.340675 0.750000 V\n0.258664 0.258664 0.500000 V\n0.741336 0.741336 0.500000 V\n0.659325 0.840675 0.750000 V\n0.840675 0.659325 0.250000 V\n0.758664 0.758664 0.000000 V\n0.033784 0.183235 0.194213 Si\n0.183235 0.033784 0.805787 Si\n0.581550 0.199315 0.459186 Si\n0.699315 0.081550 0.959186 Si\n0.199315 0.581550 0.540814 Si\n0.081550 0.699315 0.040814 Si\n0.466216 0.316765 0.694213 Si\n0.316765 0.466216 0.305787 Si\n0.259445 0.525232 0.012652 Si\n0.759445 0.025232 0.487348 Si\n0.525232 0.259445 0.987348 Si\n0.025232 0.759445 0.512652 Si\n0.474768 0.740555 0.012652 Si\n0.974768 0.240555 0.487348 Si\n0.740555 0.474768 0.987348 Si\n0.240555 0.974768 0.512652 Si\n0.533784 0.683235 0.305787 Si\n0.683235 0.533784 0.694213 Si\n0.800685 0.418450 0.459186 Si\n0.918450 0.300685 0.959186 Si\n0.418450 0.800685 0.540814 Si\n0.300685 0.918450 0.040814 Si\n0.816765 0.966216 0.194213 Si\n0.966216 0.816765 0.805787 Si\n0.244456 0.010439 0.666730 O\n0.010439 0.244456 0.333270 O\n0.166756 0.162151 0.169959 O\n0.162151 0.166756 0.830041 O\n0.089701 0.249957 0.577081 O\n0.249957 0.089701 0.422919 O\n0.410299 0.250043 0.077081 O\n0.250043 0.410299 0.922919 O\n0.333244 0.337849 0.669959 O\n0.337849 0.333244 0.330041 O\n0.513657 0.156880 0.328054 O\n0.656880 0.013657 0.828054 O\n0.156880 0.513657 0.671946 O\n0.013657 0.656880 0.171946 O\n0.497428 0.226252 0.580671 O\n0.726252 0.997428 0.080671 O\n0.997428 0.726252 0.919329 O\n0.226252 0.497428 0.419329 O\n0.097771 0.651799 0.484886 O\n0.651799 0.097771 0.515114 O\n0.597771 0.151799 0.015114 O\n0.151799 0.597771 0.984886 O\n0.255544 0.489561 0.166730 O\n0.489561 0.255544 0.833270 O\n0.054062 0.945938 0.814613 O\n0.384030 0.615970 0.971480 O\n0.674596 0.325404 0.424683 O\n0.945938 0.054062 0.185387 O\n0.825404 0.174596 0.924683 O\n0.884030 0.115970 0.528520 O\n0.615970 0.384030 0.028520 O\n0.554062 0.445938 0.685387 O\n0.445938 0.554062 0.314613 O\n0.115970 0.884030 0.471480 O\n0.325404 0.674596 0.575317 O\n0.174596 0.825404 0.075317 O\n0.510439 0.744456 0.166730 O\n0.744456 0.510439 0.833270 O\n0.402229 0.848201 0.984886 O\n0.848201 0.402229 0.015114 O\n0.902229 0.348201 0.515114 O\n0.348201 0.902229 0.484886 O\n0.273748 0.002572 0.919329 O\n0.773748 0.502572 0.580671 O\n0.002572 0.273748 0.080671 O\n0.502572 0.773748 0.419329 O\n0.986343 0.343120 0.828054 O\n0.843120 0.486343 0.328054 O\n0.486343 0.843120 0.671946 O\n0.343120 0.986343 0.171946 O\n0.666756 0.662151 0.330041 O\n0.662151 0.666756 0.669959 O\n0.589701 0.749957 0.922919 O\n0.749957 0.589701 0.077081 O\n0.750043 0.910299 0.577081 O\n0.910299 0.750043 0.422919 O\n0.837849 0.833244 0.169959 O\n0.833244 0.837849 0.830041 O\n0.989561 0.755544 0.666730 O\n0.755544 0.989561 0.333270 O\n",
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{
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{
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{
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"volume": 336.2668833181422,
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"formula_full": "Ca3 Mg1 Fe2 C6 O18",
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{
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"structure_string": "Li4 Ti4 Fe4 O16\n1.0\n-2.988502 -2.925957 4.257360\n3.073780 3.009487 4.169378\n-5.938442 6.065382 0.000026\nLi Ti Fe O\n4 4 4 16\ndirect\n0.250000 0.250000 0.250000 Li\n0.750000 0.750000 0.750000 Li\n0.750000 0.249999 0.750000 Li\n0.250000 0.750000 0.250000 Li\n0.499999 0.000002 0.000000 Ti\n0.000000 0.499999 0.500000 Ti\n0.000001 0.000002 0.999999 Ti\n0.500000 0.499998 0.500000 Ti\n0.250004 0.750001 0.750000 Fe\n0.750000 0.750001 0.249997 Fe\n0.750000 0.250001 0.250001 Fe\n0.249997 0.250003 0.750001 Fe\n0.983799 0.501098 0.268146 O\n0.483799 0.001103 0.768146 O\n0.516203 0.498895 0.268146 O\n0.016203 0.998899 0.768146 O\n0.483797 0.501100 0.731854 O\n0.983797 0.001105 0.231854 O\n0.016201 0.498897 0.731854 O\n0.516201 0.998901 0.231854 O\n0.748514 0.782722 0.005383 O\n0.248514 0.282722 0.505385 O\n0.751486 0.217274 0.005382 O\n0.251486 0.717273 0.505380 O\n0.248514 0.782726 0.994620 O\n0.748514 0.282724 0.494619 O\n0.251486 0.217277 0.994615 O\n0.751486 0.717276 0.494617 O\n",
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"formula_full": "Li4 Ti4 Fe4 O16",
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{
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]
}