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{
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{
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"created_at": "2022-09-04T14:40:03.990977Z",
"structure_string": "Ho10 Rh6\n1.0\n4.107985 -7.115239 0.000000\n4.107985 7.115239 0.000000\n0.000000 0.000000 6.291739\nHo Rh\n10 6\ndirect\n0.000000 0.751421 0.750000 Ho\n0.000000 0.248579 0.250000 Ho\n0.751421 0.751421 0.250000 Ho\n0.751421 0.000000 0.750000 Ho\n0.248579 0.248579 0.750000 Ho\n0.248579 0.000000 0.250000 Ho\n0.333333 0.666667 0.500000 Ho\n0.666667 0.333333 0.000000 Ho\n0.666667 0.333333 0.500000 Ho\n0.333333 0.666667 0.000000 Ho\n0.398530 0.000000 0.750000 Rh\n0.398530 0.398530 0.250000 Rh\n0.000000 0.601470 0.250000 Rh\n0.000000 0.398530 0.750000 Rh\n0.601470 0.601470 0.750000 Rh\n0.601470 0.000000 0.250000 Rh\n",
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{
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"structure_string": "Co4 C16 N8 Cl16\n1.0\n12.194919 0.000000 0.000000\n0.000000 7.614891 0.000000\n0.000000 0.552173 15.116316\nCo C N Cl\n4 16 8 16\ndirect\n0.794254 0.819751 0.583181 Co\n0.294254 0.180249 0.916819 Co\n0.205746 0.180249 0.416819 Co\n0.705746 0.819751 0.083181 Co\n0.952709 0.228595 0.772475 C\n0.452709 0.771405 0.727525 C\n0.047291 0.771405 0.227525 C\n0.547291 0.228595 0.272475 C\n0.598798 0.227694 0.341506 C\n0.098798 0.772306 0.158494 C\n0.401202 0.772306 0.658494 C\n0.901202 0.227694 0.841506 C\n0.028654 0.294008 0.622510 C\n0.528654 0.705992 0.877490 C\n0.971346 0.705992 0.377490 C\n0.471346 0.294008 0.122510 C\n0.725962 0.293708 0.464181 C\n0.225962 0.706292 0.035819 C\n0.274038 0.706292 0.535819 C\n0.774038 0.293708 0.964181 C\n0.998082 0.251956 0.695380 N\n0.498082 0.748044 0.804620 N\n0.001918 0.748044 0.304620 N\n0.501918 0.251956 0.195380 N\n0.661458 0.251266 0.409305 N\n0.161458 0.748734 0.090695 N\n0.338542 0.748734 0.590695 N\n0.838542 0.251266 0.909305 N\n0.968412 0.824571 0.587689 Cl\n0.468412 0.175429 0.912311 Cl\n0.031588 0.175429 0.412311 Cl\n0.531588 0.824571 0.087689 Cl\n0.730406 0.049714 0.641699 Cl\n0.230406 0.950286 0.858301 Cl\n0.269594 0.950286 0.358301 Cl\n0.769594 0.049714 0.141699 Cl\n0.736997 0.809593 0.449423 Cl\n0.236997 0.190407 0.050577 Cl\n0.263003 0.190407 0.550577 Cl\n0.763003 0.809593 0.949423 Cl\n0.739604 0.592570 0.657165 Cl\n0.239604 0.407430 0.842835 Cl\n0.260396 0.407430 0.342835 Cl\n0.760396 0.592570 0.157165 Cl\n",
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{
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"created_at": "2022-09-04T14:40:03.820019Z",
"structure_string": "Li4 Mn7 P6 O24\n1.0\n7.127104 5.613651 0.000000\n-7.127104 5.613651 0.000000\n0.000000 1.714370 6.486835\nLi Mn P O\n4 7 6 24\ndirect\n0.787860 0.787860 0.439416 Li\n0.586246 0.355978 0.520699 Li\n0.355978 0.586246 0.520699 Li\n0.115687 0.115687 0.614267 Li\n0.995297 0.357431 0.186463 Mn\n0.357431 0.995297 0.186463 Mn\n0.642912 0.342481 0.017399 Mn\n0.342481 0.642912 0.017399 Mn\n0.989118 0.989118 0.014670 Mn\n0.635642 0.996876 0.805269 Mn\n0.996876 0.635642 0.805269 Mn\n0.892298 0.277910 0.711199 P\n0.277910 0.892298 0.711199 P\n0.669805 0.669805 0.077704 P\n0.312020 0.312020 0.902394 P\n0.708386 0.084324 0.293795 P\n0.084324 0.708386 0.293795 P\n0.579312 0.753917 0.936078 O\n0.753917 0.579312 0.936078 O\n0.789763 0.789763 0.148322 O\n0.944985 0.379349 0.868451 O\n0.379349 0.944985 0.868451 O\n0.889167 0.102403 0.774948 O\n0.102403 0.889167 0.774948 O\n0.716262 0.274480 0.722088 O\n0.274480 0.716262 0.722088 O\n0.553088 0.553088 0.258485 O\n0.418950 0.418950 0.705437 O\n0.114510 0.886134 0.211687 O\n0.886134 0.114510 0.211687 O\n0.684755 0.248286 0.312916 O\n0.248286 0.684755 0.312916 O\n0.666528 0.960986 0.495332 O\n0.960986 0.666528 0.495332 O\n0.186138 0.186138 0.853906 O\n0.609848 0.030893 0.133866 O\n0.030893 0.609848 0.133866 O\n0.410254 0.234984 0.039323 O\n0.234984 0.410254 0.039323 O\n0.338208 0.001528 0.500349 O\n0.001528 0.338208 0.500349 O\n",
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{
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"structure_string": "Li4 Co5 O12\n1.0\n4.883000 0.000000 0.000000\n-2.438411 4.246796 0.000000\n-0.797662 -1.438736 9.774058\nLi Co O\n4 5 12\ndirect\n0.163495 0.346894 0.009637 Li\n0.000760 0.505785 0.490000 Li\n0.653191 0.836993 0.489023 Li\n0.255859 0.761953 0.249010 Li\n0.921411 0.073219 0.251374 Co\n0.745072 0.253530 0.750767 Co\n0.414400 0.586494 0.750156 Co\n0.589207 0.414466 0.249119 Co\n0.082200 0.920245 0.751156 Co\n0.039009 0.217127 0.649439 O\n0.295977 0.427131 0.356127 O\n0.652555 0.136685 0.359218 O\n0.579953 0.698673 0.146734 O\n0.786918 0.961003 0.848103 O\n0.854459 0.344881 0.151067 O\n0.109686 0.614177 0.848666 O\n0.212451 0.079038 0.146221 O\n0.441261 0.282718 0.848311 O\n0.379531 0.881093 0.647368 O\n0.722892 0.558732 0.648724 O\n0.921312 0.777563 0.359778 O\n",
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{
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"structure_string": "La4 Sn6 Pb6 S24\n1.0\n-4.025609 0.000000 0.000000\n0.000000 0.000000 -11.766501\n0.000000 -20.709560 0.000000\nLa Sn Pb S\n4 6 6 24\ndirect\n0.500000 0.653253 0.412495 La\n0.500000 0.153253 0.587505 La\n0.500000 0.824203 0.894830 La\n0.500000 0.324203 0.105170 La\n0.000000 0.001293 0.749832 Sn\n0.000000 0.501293 0.250168 Sn\n0.000000 0.517734 0.911406 Sn\n0.000000 0.017734 0.088594 Sn\n0.000000 0.994872 0.422950 Sn\n0.000000 0.494872 0.577050 Sn\n0.500000 0.403716 0.743328 Pb\n0.500000 0.903716 0.256672 Pb\n0.500000 0.197535 0.912550 Pb\n0.500000 0.697535 0.087450 Pb\n0.500000 0.771456 0.623024 Pb\n0.500000 0.271456 0.376976 Pb\n0.000000 0.999359 0.874203 S\n0.000000 0.499359 0.125797 S\n0.000000 0.979165 0.627395 S\n0.000000 0.479165 0.372605 S\n0.000000 0.684015 0.514405 S\n0.000000 0.184015 0.485595 S\n0.500000 0.643703 0.256584 S\n0.500000 0.143703 0.743416 S\n0.500000 0.851148 0.754928 S\n0.500000 0.351148 0.245072 S\n0.500000 0.595440 0.840606 S\n0.500000 0.095440 0.159394 S\n0.500000 0.441592 0.980926 S\n0.500000 0.941592 0.019074 S\n0.500000 0.933435 0.486092 S\n0.500000 0.433435 0.513908 S\n0.000000 0.337718 0.842762 S\n0.000000 0.837718 0.157238 S\n0.000000 0.707231 0.972742 S\n0.000000 0.207231 0.027258 S\n0.000000 0.810003 0.356193 S\n0.000000 0.310003 0.643807 S\n0.000000 0.602428 0.677644 S\n0.000000 0.102428 0.322356 S\n",
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{
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{
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"structure_string": "Mg2 Cr2 S2 F10\n1.0\n4.073830 -0.437267 -5.232084\n3.500712 -6.906677 -0.847921\n0.550758 -0.770837 -10.105554\nMg Cr S F\n2 2 2 10\ndirect\n0.442746 0.260240 0.690901 Mg\n0.460670 0.715995 0.358075 Mg\n0.490039 0.477049 0.971061 Cr\n0.470743 0.978099 0.015182 Cr\n0.260225 0.447440 0.323730 S\n0.847906 0.702448 0.551976 S\n0.576048 0.876609 0.154488 F\n0.674403 0.437274 0.196340 F\n0.378534 0.073106 0.867395 F\n0.503403 0.425077 0.761546 F\n0.915238 0.581398 0.239768 F\n0.040184 0.832727 0.690826 F\n0.047405 0.377460 0.749308 F\n0.917097 0.132162 0.348676 F\n0.377764 0.754223 0.045309 F\n0.584326 0.195821 0.967432 F\n",
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{
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"structure_string": "Cr8 Bi8 O40\n1.0\n7.342903 0.000000 0.000000\n0.000000 9.900815 0.000000\n0.000000 0.000000 11.274484\nCr Bi O\n8 8 40\ndirect\n0.658843 0.411204 0.641461 Cr\n0.341157 0.088796 0.141461 Cr\n0.841157 0.911204 0.358539 Cr\n0.158843 0.588796 0.858539 Cr\n0.341157 0.588796 0.358539 Cr\n0.658843 0.911204 0.858539 Cr\n0.158843 0.088796 0.641461 Cr\n0.841157 0.411204 0.141461 Cr\n0.491639 0.824877 0.589904 Bi\n0.508361 0.675123 0.089904 Bi\n0.008361 0.324877 0.410096 Bi\n0.991639 0.175123 0.910096 Bi\n0.508361 0.175123 0.410096 Bi\n0.491639 0.324877 0.910096 Bi\n0.991639 0.675123 0.589904 Bi\n0.008361 0.824877 0.089904 Bi\n0.719093 0.815042 0.980650 O\n0.280907 0.684958 0.480650 O\n0.780907 0.315042 0.019350 O\n0.219093 0.184958 0.519350 O\n0.280907 0.184958 0.019350 O\n0.719093 0.315042 0.519350 O\n0.219093 0.684958 0.980650 O\n0.780907 0.815042 0.480650 O\n0.756351 0.853374 0.736016 O\n0.243649 0.646626 0.236016 O\n0.743649 0.353374 0.263984 O\n0.256351 0.146626 0.763984 O\n0.243649 0.146626 0.263984 O\n0.756351 0.353374 0.763984 O\n0.256351 0.646626 0.736016 O\n0.743649 0.853374 0.236016 O\n0.442501 0.894770 0.838660 O\n0.557499 0.605230 0.338660 O\n0.057499 0.394770 0.161340 O\n0.942501 0.105230 0.661340 O\n0.557499 0.105230 0.161340 O\n0.442501 0.394770 0.661340 O\n0.942501 0.605230 0.838660 O\n0.057499 0.894770 0.338660 O\n0.703274 0.077598 0.879165 O\n0.296726 0.422402 0.379165 O\n0.796726 0.577598 0.120835 O\n0.203274 0.922402 0.620835 O\n0.296726 0.922402 0.120835 O\n0.703274 0.577598 0.620835 O\n0.203274 0.422402 0.879165 O\n0.796726 0.077598 0.379165 O\n0.461522 0.947621 0.422131 O\n0.538478 0.552379 0.922131 O\n0.038478 0.447621 0.577869 O\n0.961522 0.052379 0.077869 O\n0.538478 0.052379 0.577869 O\n0.461522 0.447621 0.077869 O\n0.961522 0.552379 0.422131 O\n0.038478 0.947621 0.922131 O\n",
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{
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{
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"structure_string": "Li6 Cr3 Fe3 O12\n1.0\n4.445562 4.941153 0.000000\n-4.445562 4.941153 0.000000\n0.000000 0.874123 5.059077\nLi Cr Fe O\n6 3 3 12\ndirect\n0.835173 0.665697 0.250339 Li\n0.500228 0.000473 0.244816 Li\n0.999527 0.499772 0.755184 Li\n0.664357 0.832200 0.750358 Li\n0.167800 0.335643 0.249642 Li\n0.334303 0.164827 0.749661 Li\n0.580516 0.419484 0.000000 Cr\n0.414881 0.585119 0.500000 Cr\n0.085784 0.914216 0.500000 Cr\n0.250059 0.749941 0.000000 Fe\n0.919428 0.080572 0.000000 Fe\n0.750344 0.249656 0.500000 Fe\n0.974333 0.800583 0.870720 O\n0.524909 0.697113 0.128259 O\n0.634222 0.137743 0.872212 O\n0.302887 0.475091 0.871741 O\n0.862257 0.365778 0.127788 O\n0.803265 0.966619 0.372365 O\n0.138816 0.639543 0.363989 O\n0.199417 0.025667 0.129280 O\n0.695168 0.531308 0.630444 O\n0.468692 0.304832 0.369556 O\n0.360457 0.861184 0.636011 O\n0.033381 0.196735 0.627635 O\n",
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"formula_full": "Li6 Cr3 Fe3 O12",
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}