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"structure_string": "V4 O2 F14\n1.0\n5.262954 -0.000000 0.000000\n-0.000000 5.572079 0.872392\n-0.000000 -0.309280 8.951907\nV O F\n4 2 14\ndirect\n0.668838 0.178380 0.801471 V\n0.331162 0.178380 0.301471 V\n0.163552 0.832809 0.672146 V\n0.836448 0.832809 0.172145 V\n0.469940 0.958850 0.776869 O\n0.530059 0.958850 0.276869 O\n0.351266 0.649902 0.576063 F\n0.054679 0.611517 0.815431 F\n0.259469 0.104409 0.513578 F\n0.129683 -0.161811 0.078224 F\n-0.012253 0.076019 0.292261 F\n0.740530 0.104409 0.013578 F\n0.012253 0.076019 0.792261 F\n0.273760 0.310203 0.117492 F\n0.494330 0.417792 0.849686 F\n0.505669 0.417792 0.349686 F\n0.648733 0.649902 0.076063 F\n-0.054679 0.611517 0.315431 F\n0.870316 -0.161811 0.578225 F\n0.726240 0.310203 0.617492 F\n",
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{
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"updated_at": "2022-09-04T14:38:53.614491Z",
"structure_string": "Nb6 V2 Se12\n1.0\n6.052849 -0.000000 0.000000\n-3.026424 5.241921 0.000000\n-0.000000 -0.000000 12.685490\nNb V Se\n6 2 12\ndirect\n0.000000 0.000000 0.500000 Nb\n0.000000 0.000000 0.000000 Nb\n0.333334 0.666667 0.999237 Nb\n0.666667 0.333333 0.000763 Nb\n0.666667 0.333333 0.499237 Nb\n0.333334 0.666667 0.500763 Nb\n0.333334 0.666667 0.250000 V\n0.666667 0.333333 0.750000 V\n0.668989 0.666916 0.133762 Se\n0.002072 0.333083 0.866238 Se\n0.331012 0.997928 0.866238 Se\n0.666917 0.668988 0.866238 Se\n0.666917 0.997928 0.633762 Se\n0.668989 0.002072 0.366238 Se\n0.331012 0.333083 0.633762 Se\n0.997929 0.666916 0.366238 Se\n0.997929 0.331011 0.133762 Se\n0.333084 0.331011 0.366238 Se\n0.002072 0.668988 0.633762 Se\n0.333084 0.002072 0.133762 Se\n",
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"structure_string": "Nd1 Mn5 Cu2 O12\n1.0\n5.990933 -0.087141 -2.130637\n-2.952571 5.202970 -2.156365\n-0.025627 0.087141 6.358478\nNd Mn Cu O\n1 5 2 12\ndirect\n0.000000 0.000000 0.000000 Nd\n0.000000 0.500000 -0.000000 Mn\n0.500000 0.500000 0.499999 Mn\n-0.000000 -0.000000 0.500000 Mn\n0.500000 0.000000 -0.000000 Mn\n0.500000 0.500000 -0.000001 Mn\n0.499999 -0.000000 0.500000 Cu\n-0.000000 0.500000 0.500000 Cu\n0.127133 0.304144 0.822988 O\n0.481156 0.304145 0.177011 O\n0.821281 0.120585 0.299304 O\n0.178718 0.478023 0.299304 O\n0.821281 0.521977 0.700695 O\n0.303467 0.181400 0.484867 O\n0.696532 0.181400 0.877932 O\n0.696532 0.818600 0.515132 O\n0.872866 0.695855 0.177010 O\n0.303467 0.818600 0.122066 O\n0.178718 0.879415 0.700695 O\n0.518843 0.695855 0.822988 O\n",
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{
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"created_at": "2022-09-04T14:38:54.987930Z",
"updated_at": "2022-09-04T14:38:54.987961Z",
"structure_string": "Bi8 O12\n1.0\n7.722295 0.000000 0.000000\n-3.861147 6.687704 0.000000\n-0.000000 -0.000000 5.983759\nBi O\n8 12\ndirect\n0.176251 0.352502 0.226432 Bi\n0.176251 0.823748 0.226432 Bi\n0.647496 0.823748 0.226432 Bi\n0.823747 0.647497 0.726432 Bi\n0.823748 0.176252 0.726432 Bi\n0.352502 0.176252 0.726432 Bi\n0.666666 0.333333 0.228588 Bi\n0.333333 0.666666 0.728588 Bi\n0.129133 0.258267 0.837448 O\n0.258267 0.129133 0.337447 O\n0.870866 0.129133 0.337447 O\n0.870866 0.741732 0.337447 O\n0.537266 0.074533 0.006267 O\n0.074533 0.537266 0.506267 O\n0.537266 0.462733 0.006267 O\n0.462733 0.925466 0.506267 O\n0.129133 0.870866 0.837448 O\n0.462733 0.537266 0.506267 O\n0.925466 0.462733 0.006267 O\n0.741732 0.870866 0.837448 O\n",
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{
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"updated_at": "2022-09-04T14:38:52.872769Z",
"structure_string": "Na2 Ti2 Si4 O12\n1.0\n5.173552 -0.011195 1.093310\n1.234647 6.448772 0.754668\n-0.016885 0.015900 6.609065\nNa Ti Si O\n2 2 4 12\ndirect\n0.250039 0.193304 0.306825 Na\n0.749960 0.806695 0.693175 Na\n0.750011 0.412369 0.087643 Ti\n0.249989 0.587630 0.912356 Ti\n0.259149 0.699144 0.386843 Si\n0.740850 0.300854 0.613157 Si\n0.759142 0.886871 0.199081 Si\n0.240858 0.113128 0.800918 Si\n0.149372 0.292646 0.967512 O\n0.850628 0.707353 0.032488 O\n0.008418 0.134630 0.661064 O\n0.991581 0.865369 0.338936 O\n0.508408 0.161016 0.634668 O\n0.813822 0.394490 0.376471 O\n0.649368 0.467480 0.792646 O\n0.350632 0.532519 0.207354 O\n0.686155 0.123562 0.105461 O\n0.186178 0.605509 0.623528 O\n0.491592 0.838983 0.365332 O\n0.313844 0.876437 0.894539 O\n",
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"updated_at": "2022-09-04T14:38:52.913594Z",
"structure_string": "Sr4 Zr3 Ti1 O12\n1.0\n5.762668 0.002107 0.003230\n0.003942 5.773380 0.002559\n0.001000 0.003594 8.173257\nSr Zr Ti O\n4 3 1 12\ndirect\n0.503347 0.024836 0.757614 Sr\n0.997074 0.521774 0.758053 Sr\n0.496653 0.975164 0.242387 Sr\n0.002926 0.478226 0.241947 Sr\n-0.000000 -0.000000 0.500000 Zr\n0.500000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Zr\n0.500000 0.500000 0.000000 Ti\n0.202912 0.702463 0.464673 O\n0.276405 0.237619 0.030386 O\n0.238307 0.723550 0.032275 O\n0.297768 0.202947 0.467452 O\n0.797088 0.297537 0.535328 O\n0.066473 0.984187 0.751088 O\n0.933527 0.015813 0.248913 O\n0.560363 0.509924 0.241084 O\n0.702232 0.797052 0.532549 O\n0.439637 0.490076 0.758916 O\n0.723595 0.762381 0.969614 O\n0.761693 0.276450 0.967725 O\n",
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"structure_string": "Na3 Pd5 F12\n1.0\n7.061055 -0.082814 2.164444\n3.700846 6.014074 2.164444\n0.097843 0.053925 6.782965\nNa Pd F\n3 5 12\ndirect\n0.000000 0.000000 0.000000 Na\n0.741130 0.258869 0.499999 Na\n0.258870 0.741130 0.499999 Na\n0.769593 0.769593 0.467052 Pd\n0.230407 0.230406 0.532946 Pd\n0.500000 0.500000 -0.000001 Pd\n0.499999 0.000000 -0.000000 Pd\n0.000000 0.500000 -0.000000 Pd\n0.780459 0.362763 0.116042 F\n0.219541 0.637236 0.883957 F\n0.637237 0.219540 0.883957 F\n0.362763 0.780459 0.116042 F\n0.068124 0.068123 0.619785 F\n0.391191 0.391190 0.466970 F\n0.204681 0.204680 0.843997 F\n0.795319 0.795319 0.156001 F\n0.243236 0.243236 0.229753 F\n0.608809 0.608809 0.533028 F\n0.931876 0.931876 0.380213 F\n0.756764 0.756763 0.770245 F\n",
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"structure_string": "Sc4 Be2 B4 Ir10\n1.0\n9.320418 0.000000 0.000000\n0.000000 9.320418 0.000000\n-0.000000 0.000000 2.977485\nSc Be B Ir\n4 2 4 10\ndirect\n0.676421 0.176420 -0.000000 Sc\n0.323580 0.823580 -0.000000 Sc\n0.176420 0.323580 -0.000000 Sc\n0.823580 0.676421 -0.000000 Sc\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 -0.000000 Be\n0.628576 0.871424 -0.000000 B\n0.371424 0.128576 -0.000000 B\n0.128576 0.628576 -0.000000 B\n0.871424 0.371424 -0.000000 B\n0.500000 0.000000 0.500001 Ir\n0.208265 0.067269 0.500001 Ir\n0.791735 0.932731 0.500001 Ir\n0.067269 0.791735 0.500001 Ir\n0.708266 0.432731 0.500001 Ir\n0.932731 0.208265 0.500001 Ir\n0.291735 0.567269 0.500001 Ir\n0.567269 0.708266 0.500001 Ir\n0.432731 0.291735 0.500001 Ir\n-0.000000 0.500000 0.500001 Ir\n",
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"updated_at": "2022-09-04T14:38:53.772711Z",
"structure_string": "Np8 C12\n1.0\n6.577450 0.000000 -2.325481\n-3.288725 5.696239 -2.325481\n-0.000000 -0.000000 6.976441\nNp C\n8 12\ndirect\n0.597612 0.500000 -0.000000 Np\n0.500000 0.000000 0.597612 Np\n-0.000000 0.597612 0.500000 Np\n0.902387 0.902388 0.902388 Np\n0.500000 -0.000000 0.097612 Np\n0.097612 0.500000 -0.000000 Np\n-0.000000 0.097612 0.500000 Np\n0.402387 0.402388 0.402388 Np\n0.462825 0.712826 0.750000 C\n0.037174 0.787174 0.250000 C\n0.250000 0.212826 0.962826 C\n0.750000 0.287174 0.537174 C\n0.750000 0.462826 0.712826 C\n0.712825 0.750000 0.462826 C\n0.962826 0.250000 0.212826 C\n0.537173 0.750000 0.287174 C\n0.287174 0.537174 0.750000 C\n0.787174 0.250000 0.037174 C\n0.250000 0.037174 0.787174 C\n0.212825 0.962826 0.250000 C\n",
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{
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"created_at": "2022-09-04T14:38:45.484317Z",
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}