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{
"id": "jvasp-44652",
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"structure_string": "Li4 Ti1 Co3 O8\n1.0\n5.054401 -0.011447 -0.011614\n0.023403 5.454391 -0.000415\n0.033786 0.022943 6.345161\nLi Ti Co O\n4 1 3 8\ndirect\n0.002321 0.916262 0.621971 Li\n0.506917 0.582650 0.126865 Li\n0.000875 0.421818 0.872914 Li\n0.507123 0.083169 0.377516 Li\n0.499186 0.081512 0.876845 Ti\n0.010782 0.911096 0.139769 Co\n0.489589 0.578135 0.616933 Co\n0.997785 0.418563 0.369933 Co\n0.623432 0.926496 0.115111 O\n0.610402 0.915320 0.639309 O\n0.111482 0.588438 0.132415 O\n0.125692 0.574412 0.610850 O\n0.631865 0.424702 0.383226 O\n0.610025 0.403656 0.868944 O\n0.112467 0.096904 0.366855 O\n0.133660 0.076855 0.880545 O\n",
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{
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"structure_string": "Li4 Al1 Cr3 O8\n1.0\n5.037104 -0.000191 -0.000117\n-0.839038 4.971559 -0.008056\n-0.000955 -1.692526 5.563966\nLi Al Cr O\n4 1 3 8\ndirect\n0.750854 0.000304 0.875968 Li\n0.252670 0.998179 0.625589 Li\n0.747328 0.001821 0.374410 Li\n0.249144 0.999695 0.124031 Li\n0.499999 0.500000 -0.000001 Al\n0.999870 0.499267 0.751679 Cr\n0.499999 0.500000 0.500000 Cr\n0.000128 0.500732 0.248320 Cr\n0.624195 0.277044 0.702122 O\n0.375036 0.721039 0.813285 O\n0.128161 0.273579 0.443027 O\n0.871837 0.726421 0.556972 O\n0.624962 0.278961 0.186714 O\n0.375803 0.722955 0.297878 O\n0.140682 0.277090 0.944646 O\n0.859316 0.722910 0.055354 O\n",
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{
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"updated_at": "2022-09-04T14:38:06.262681Z",
"structure_string": "Li4 Mn2 Cr2 O8\n1.0\n-2.908803 2.874298 4.363274\n2.874298 -2.908803 4.363274\n2.896031 2.896031 -4.385765\nLi Mn Cr O\n4 2 2 8\ndirect\n0.500000 0.000000 0.000000 Li\n0.500000 0.500000 0.500001 Li\n0.000000 0.500000 0.500000 Li\n0.500000 0.500000 0.000001 Li\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.500000 0.000000 0.500000 Cr\n0.000000 0.500000 0.000000 Cr\n0.775607 0.253750 0.992197 O\n0.239463 0.251275 0.972696 O\n0.746251 0.224394 0.507804 O\n0.748725 0.760538 0.527305 O\n0.251275 0.239462 0.472697 O\n0.760538 0.748725 0.027305 O\n0.253750 0.775606 0.492197 O\n0.224394 0.746251 0.007805 O\n",
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{
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"updated_at": "2022-09-04T14:38:08.626244Z",
"structure_string": "Li4 V1 Cr3 O8\n1.0\n-5.026554 0.000112 -0.000841\n-0.000277 -5.807134 -0.000717\n1.681202 2.902745 4.818282\nLi V Cr O\n4 1 3 8\ndirect\n0.005295 0.752205 0.004395 Li\n0.994705 0.247793 0.995604 Li\n0.500000 0.000000 0.000000 Li\n0.500000 0.500000 -0.000000 Li\n0.500000 0.499999 0.500000 V\n-0.000006 0.252994 0.500003 Cr\n0.000006 0.747004 0.499996 Cr\n0.500000 -0.000000 0.500000 Cr\n0.758984 0.382578 0.265139 O\n0.758231 0.888382 0.276745 O\n0.255583 0.132759 0.268234 O\n0.744417 0.867239 0.731765 O\n0.744414 0.364505 0.731772 O\n0.241016 0.617420 0.734860 O\n0.255586 0.635493 0.268228 O\n0.241769 0.111617 0.723254 O\n",
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{
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"structure_string": "Li4 Mg1 Co3 O8\n1.0\n-1.621484 2.498140 4.873401\n0.000000 2.978240 -4.873401\n-4.968775 1.507052 -2.425743\nLi Mg Co O\n4 1 3 8\ndirect\n0.500000 -0.000000 0.500000 Li\n0.500000 0.500000 0.500000 Li\n-0.000000 -0.000001 0.500000 Li\n0.000000 0.499999 0.500000 Li\n0.000000 0.000000 0.000000 Mg\n0.500000 0.000000 -0.000000 Co\n0.500000 0.500000 -0.000000 Co\n0.000000 0.500000 -0.000000 Co\n0.738532 0.477063 0.784405 O\n0.726815 0.975958 0.774898 O\n0.249144 0.498287 0.774898 O\n0.249144 0.975958 0.774898 O\n0.750856 0.024042 0.225102 O\n0.750856 0.501712 0.225102 O\n0.273185 0.024041 0.225102 O\n0.261468 0.522937 0.215595 O\n",
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{
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"created_at": "2022-09-04T14:38:19.071663Z",
"updated_at": "2022-09-04T14:38:19.071686Z",
"structure_string": "B2 H12 N2\n1.0\n5.360421 0.000000 0.000000\n0.000000 4.975483 0.000000\n0.000000 0.000000 4.727991\nB H N\n2 12 2\ndirect\n0.500000 0.188687 0.675622 B\n0.000000 0.688686 0.324378 B\n0.500000 0.162013 0.416859 H\n0.500000 0.543312 0.955187 H\n0.000000 0.043312 0.044813 H\n0.812139 0.588626 0.222314 H\n0.187861 0.588626 0.222314 H\n0.844392 0.095564 0.342799 H\n0.155608 0.095564 0.342799 H\n0.000000 0.662013 0.583141 H\n0.655608 0.595564 0.657201 H\n0.344392 0.595564 0.657201 H\n0.687861 0.088626 0.777686 H\n0.312139 0.088626 0.777686 H\n0.500000 0.502808 0.741624 N\n0.000000 0.002808 0.258376 N\n",
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{
"id": "jvasp-86277",
"created_at": "2022-09-04T14:38:18.149737Z",
"updated_at": "2022-09-04T14:38:18.149756Z",
"structure_string": "Ho10 Co4 Bi2\n1.0\n6.790750 0.000000 -3.221399\n-1.528169 6.616570 -3.221399\n-0.052131 -0.065544 8.658301\nHo Co Bi\n10 4 2\ndirect\n0.527744 0.714851 0.742594 Ho\n0.972256 0.472256 0.257405 Ho\n0.285149 0.785150 0.257405 Ho\n0.027744 0.527744 0.742594 Ho\n0.000000 0.000000 0.000000 Ho\n0.214851 0.027744 0.742595 Ho\n0.472256 0.285150 0.257406 Ho\n0.714851 0.214851 0.742594 Ho\n0.785149 0.972256 0.257405 Ho\n0.500000 0.500000 -0.000000 Ho\n0.639511 0.139511 -0.000000 Co\n0.360489 0.860489 -0.000000 Co\n0.860489 0.639511 -0.000000 Co\n0.139511 0.360489 -0.000000 Co\n0.250000 0.250000 0.500000 Bi\n0.750000 0.750000 0.500000 Bi\n",
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{
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"created_at": "2022-09-04T14:38:08.066788Z",
"updated_at": "2022-09-04T14:38:08.066810Z",
"structure_string": "Cr4 O12\n1.0\n5.101324 0.000000 0.000000\n0.000000 5.654633 0.000000\n0.000000 0.000000 7.940245\nCr O\n4 12\ndirect\n0.561032 0.262295 0.311287 Cr\n0.061032 0.237705 0.811288 Cr\n0.938967 0.762295 0.311287 Cr\n0.438967 0.737705 0.811288 Cr\n0.879894 0.202454 0.649961 O\n0.311101 0.028451 0.811287 O\n0.379895 0.297546 0.472614 O\n0.879894 0.202453 0.972614 O\n0.811101 0.471548 0.311287 O\n0.379895 0.297546 0.149960 O\n0.620105 0.702453 0.649961 O\n0.188899 0.528451 0.811287 O\n0.120105 0.797546 0.472614 O\n0.620105 0.702453 0.972614 O\n0.688898 0.971548 0.311287 O\n0.120105 0.797546 0.149960 O\n",
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{
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"created_at": "2022-09-04T14:38:05.709638Z",
"updated_at": "2022-09-04T14:38:05.709664Z",
"structure_string": "Li4 Al2 V2 O8\n1.0\n4.855632 0.000000 0.000000\n0.000000 5.521625 0.000000\n0.000000 0.000000 6.336397\nLi Al V O\n4 2 2 8\ndirect\n0.011209 0.666315 0.251402 Li\n0.511209 0.333684 0.248598 Li\n0.011209 0.666315 0.748599 Li\n0.511209 0.333684 0.751402 Li\n0.503332 0.827945 0.000000 Al\n0.003332 0.172054 0.500000 Al\n0.014532 0.171106 0.000000 V\n0.514531 0.828893 0.500000 V\n0.133884 0.842442 0.000000 O\n0.615178 0.137117 0.000000 O\n0.105327 0.322909 0.263623 O\n0.605327 0.677090 0.236378 O\n0.115178 0.862882 0.500000 O\n0.633884 0.157557 0.500000 O\n0.605327 0.677090 0.763623 O\n0.105327 0.322909 0.736378 O\n",
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{
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"created_at": "2022-09-04T14:38:08.127356Z",
"updated_at": "2022-09-04T14:38:08.127384Z",
"structure_string": "Li4 Mn2 Ni2 O8\n1.0\n5.793512 -0.193142 0.051408\n0.159852 5.794526 0.051408\n-2.940713 -2.766850 4.035977\nLi Mn Ni O\n4 2 2 8\ndirect\n0.000000 0.500001 0.500001 Li\n0.500000 0.500001 0.500001 Li\n0.500000 0.000000 0.000000 Li\n0.500000 0.500001 0.000000 Li\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n-0.000000 0.500000 0.000000 Ni\n0.500000 0.000000 0.500001 Ni\n0.233693 0.766310 0.005997 O\n0.225120 0.230044 0.477579 O\n0.233691 0.766307 0.494005 O\n0.769957 0.774881 0.022423 O\n0.230044 0.225121 0.977579 O\n0.766309 0.233694 0.505997 O\n0.774880 0.769958 0.522423 O\n0.766307 0.233692 0.994005 O\n",
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{
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"updated_at": "2022-09-04T14:38:08.234542Z",
"structure_string": "Fe8 Ni4 P4\n1.0\n4.133371 0.000000 1.440290\n2.066686 6.367871 0.720144\n-0.028658 -0.000000 6.733406\nFe Ni P\n8 4 4\ndirect\n0.876977 0.816281 0.972540 Fe\n0.345642 0.667832 0.609179 Fe\n0.306742 0.027460 0.816281 Fe\n0.150484 0.972540 0.183719 Fe\n0.622651 0.332168 0.390821 Fe\n0.665798 0.183719 0.027460 Fe\n0.986526 0.390821 0.667832 Fe\n0.045181 0.609179 0.332168 Fe\n0.923690 0.044215 0.606830 Ni\n0.032095 0.393170 0.044214 Ni\n0.469479 0.606830 0.955785 Ni\n0.574736 0.955785 0.393170 Ni\n0.195725 0.248500 0.334336 P\n0.469939 0.334336 0.751501 P\n0.778560 0.751500 0.665664 P\n0.555777 0.665664 0.248499 P\n",
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{
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"structure_string": "Hf2 Fe2 Cl12\n1.0\n3.105876 -5.379535 0.000000\n3.105876 5.379535 0.000000\n0.000000 0.000000 11.680777\nHf Fe Cl\n2 2 12\ndirect\n0.333333 0.666668 0.750000 Hf\n0.666668 0.333333 0.250000 Hf\n0.000000 0.000000 0.750000 Fe\n0.000000 0.000000 0.250000 Fe\n0.665241 0.681864 0.870828 Cl\n0.016623 0.334760 0.870828 Cl\n0.318138 0.983378 0.870828 Cl\n0.016623 0.681864 0.629172 Cl\n0.334760 0.016623 0.370828 Cl\n0.681864 0.665241 0.370828 Cl\n0.983378 0.318138 0.370828 Cl\n0.681864 0.016623 0.129172 Cl\n0.983378 0.665241 0.129172 Cl\n0.334760 0.318138 0.129172 Cl\n0.665241 0.983378 0.629172 Cl\n0.318138 0.334760 0.629172 Cl\n",
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]
}