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{
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"structure_string": "Na2 H6 C2 N8 O2\n1.0\n5.599075 0.000000 0.000000\n0.000000 5.845678 0.000000\n-0.000000 0.000000 6.280788\nNa H C N O\n2 6 2 8 2\ndirect\n0.000000 0.000000 0.500000 Na\n0.000000 0.000000 0.000000 Na\n0.183695 0.500000 0.250000 H\n0.816306 0.500000 0.750000 H\n0.423633 0.137315 0.250000 H\n0.576368 0.137315 0.750000 H\n0.576368 0.862686 0.750000 H\n0.423633 0.862686 0.250000 H\n0.010711 0.500000 0.750000 C\n0.989290 0.500000 0.250000 C\n0.626855 0.387698 0.250000 N\n0.373146 0.387698 0.750000 N\n0.373146 0.612303 0.750000 N\n0.626855 0.612303 0.250000 N\n0.854560 0.310610 0.250000 N\n0.145441 0.310610 0.750000 N\n0.145441 0.689391 0.750000 N\n0.854560 0.689391 0.250000 N\n0.318116 0.000000 0.250000 O\n0.681885 0.000000 0.750000 O\n",
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{
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"structure_string": "Li10 Br1 N3\n1.0\n3.669303 -6.355420 0.000000\n3.669303 6.355420 -0.000000\n-0.000000 0.000000 3.832182\nLi Br N\n10 1 3\ndirect\n0.221369 0.442738 0.000000 Li\n0.221368 0.778631 0.000000 Li\n0.557262 0.778631 0.000000 Li\n0.832380 0.664761 0.000000 Li\n0.984017 0.492009 0.500000 Li\n0.507990 0.492009 0.500000 Li\n0.507990 0.015982 0.500000 Li\n0.666667 0.333333 0.000000 Li\n0.335238 0.167619 0.000000 Li\n0.832380 0.167619 0.000000 Li\n0.000000 0.000000 0.500000 Br\n0.982955 0.491478 0.000000 N\n0.508522 0.017044 0.000000 N\n0.508521 0.491478 0.000000 N\n",
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"structure_string": "H6 C13 S3 O1\n1.0\n3.574016 0.191502 1.235230\n1.101883 5.768145 1.206630\n0.678452 0.391818 12.847676\nH C S O\n6 13 3 1\ndirect\n0.450648 0.132065 0.138072 H\n0.400996 0.089082 0.783358 H\n0.893187 0.901615 0.632648 H\n0.394962 0.126090 0.980472 H\n0.454463 0.094662 0.343078 H\n0.898277 0.901858 0.430156 H\n0.078516 0.622575 0.042393 C\n0.134667 0.523294 0.645195 C\n0.139315 0.523358 0.448862 C\n0.171157 0.469487 0.755922 C\n0.166989 0.505947 0.145571 C\n0.180190 0.469714 0.341549 C\n0.995521 0.744014 0.483636 C\n0.992835 0.743922 0.592675 C\n0.331247 0.278773 0.186189 C\n0.306426 0.256003 0.815601 C\n0.336105 0.258376 0.297093 C\n0.298997 0.276158 0.923276 C\n0.154592 0.505639 0.947027 C\n0.270975 0.313708 0.555719 S\n0.030140 0.696850 0.834796 S\n0.025735 0.694516 0.244632 S\n0.923163 0.840083 0.035667 O\n",
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{
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"structure_string": "Li12 B4 N8\n1.0\n0.000000 5.115285 0.005787\n7.050604 0.000000 0.000000\n0.000000 -2.615302 -6.183158\nLi B N\n12 4 8\ndirect\n0.249893 0.515503 0.499084 Li\n0.257656 0.207733 0.686586 Li\n0.257656 0.292267 0.186585 Li\n0.742345 0.792267 0.313414 Li\n0.251901 0.512027 0.875160 Li\n0.748101 0.012027 0.624840 Li\n0.742345 0.707732 0.813415 Li\n0.251901 0.987973 0.375160 Li\n0.249894 0.984496 0.999084 Li\n0.750108 0.484496 0.500916 Li\n0.750108 0.015503 0.000915 Li\n0.748100 0.487973 0.124840 Li\n0.785256 0.319615 0.823855 B\n0.214746 0.819615 0.676145 B\n0.214746 0.680385 0.176145 B\n0.785255 0.180385 0.323855 B\n0.006656 0.203033 0.865388 N\n0.434836 0.561498 0.218193 N\n0.565165 0.061498 0.281806 N\n0.565165 0.438502 0.781807 N\n0.434836 0.938502 0.718193 N\n0.993345 0.796966 0.134612 N\n0.006656 0.296966 0.365387 N\n0.993346 0.703033 0.634612 N\n",
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{
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{
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"created_at": "2022-09-04T14:36:38.814002Z",
"updated_at": "2022-09-04T14:36:38.814028Z",
"structure_string": "K6 P2\n1.0\n2.828523 -4.899146 0.000000\n2.828523 4.899146 -0.000000\n-0.000000 0.000000 10.004372\nK P\n6 2\ndirect\n0.333332 0.666667 0.419808 K\n0.666667 0.333332 0.919807 K\n0.666667 0.333332 0.580192 K\n0.333332 0.666667 0.080192 K\n0.000000 0.000000 0.250000 K\n0.000000 0.000000 0.750000 K\n0.666667 0.333332 0.250000 P\n0.333332 0.666667 0.750000 P\n",
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"structure_string": "Na1 Mg6 Al1\n1.0\n6.415825 -0.005889 0.000000\n-3.213012 5.565100 0.000000\n0.000000 0.000000 5.130390\nNa Mg Al\n1 6 1\ndirect\n0.168645 0.834322 0.250000 Na\n0.668651 0.336588 0.250000 Mg\n0.668651 0.832063 0.250000 Mg\n0.329961 0.171340 0.750000 Mg\n0.329961 0.658622 0.750000 Mg\n0.834341 0.167171 0.750000 Mg\n0.827267 0.663632 0.750000 Mg\n0.172528 0.336265 0.250000 Al\n",
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"structure_string": "Rb1 Ca3\n1.0\n5.774669 -0.000000 0.000000\n0.000000 5.774669 -0.000000\n0.000000 -0.000000 5.774669\nRb Ca\n1 3\ndirect\n0.000000 0.000000 0.000000 Rb\n0.000000 0.500000 0.500000 Ca\n0.500000 0.000000 0.500000 Ca\n0.500000 0.500000 0.000000 Ca\n",
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{
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}