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"structure_string": "Hg4 Se4 O12\n1.0\n4.275964 -0.040075 0.000000\n-1.596405 7.264970 0.000000\n0.000000 0.000000 10.386680\nHg Se O\n4 4 12\ndirect\n0.091977 0.403899 0.828043 Hg\n0.908023 0.596100 0.171957 Hg\n0.908023 0.096100 0.328043 Hg\n0.091977 0.903899 0.671957 Hg\n0.345504 0.679155 0.424425 Se\n0.345503 0.179155 0.075575 Se\n0.654496 0.820845 0.924425 Se\n0.654496 0.320845 0.575575 Se\n0.500729 0.276204 0.216303 O\n0.161537 0.857792 0.475652 O\n0.838463 0.642207 0.975652 O\n0.988799 0.478378 0.638041 O\n0.011200 0.021621 0.138041 O\n0.499270 0.223795 0.716303 O\n0.011201 0.521621 0.361959 O\n0.500730 0.776204 0.283697 O\n0.988800 0.978378 0.861959 O\n0.838463 0.142207 0.524348 O\n0.161536 0.357792 0.024348 O\n0.499271 0.723795 0.783697 O\n",
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{
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"structure_string": "Yb3 Ti3 O14\n1.0\n5.833047 -0.168574 3.092430\n1.724096 5.780546 3.186648\n-0.368323 -0.137708 6.810824\nYb Ti O\n3 3 14\ndirect\n0.500000 0.000000 0.499999 Yb\n0.500000 0.500001 -0.000000 Yb\n0.500001 0.500001 0.499999 Yb\n0.000000 -0.000000 0.500000 Ti\n0.000000 0.500000 -0.000000 Ti\n0.500000 0.000000 -0.000000 Ti\n0.318585 0.379513 0.379512 O\n0.096486 0.714686 0.714685 O\n0.324498 0.922153 0.321070 O\n0.324498 0.321071 0.922152 O\n0.681416 0.620488 0.620486 O\n0.669549 0.102824 0.102823 O\n0.903614 0.849482 0.359551 O\n0.330452 0.897177 0.897176 O\n0.096388 0.150519 0.640447 O\n0.903614 0.359553 0.849480 O\n0.675503 0.678930 0.077847 O\n0.675503 0.077848 0.678929 O\n0.903516 0.285315 0.285314 O\n0.096388 0.640448 0.150519 O\n",
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{
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"created_at": "2022-09-04T14:36:02.717587Z",
"updated_at": "2022-09-04T14:36:02.717611Z",
"structure_string": "Tc8 As12\n1.0\n6.569324 0.000380 -1.369745\n-1.855281 6.417626 -0.656812\n0.012383 0.009724 8.076213\nTc As\n8 12\ndirect\n0.909334 0.123399 0.623921 Tc\n0.469478 0.135643 0.634356 Tc\n0.530521 0.864357 0.365644 Tc\n0.633089 0.570164 0.867791 Tc\n0.366910 0.429836 0.132209 Tc\n0.083881 0.573296 0.858216 Tc\n0.916118 0.426704 0.141784 Tc\n0.090666 0.876601 0.376080 Tc\n0.967631 0.806643 0.049974 As\n0.032368 0.193357 0.950026 As\n0.736478 0.593731 0.346469 As\n0.628081 0.846309 0.679928 As\n0.371918 0.153691 0.320072 As\n0.141209 0.874083 0.686157 As\n0.858790 0.125917 0.313843 As\n0.764688 0.434023 0.614865 As\n0.235312 0.565977 0.385135 As\n0.263522 0.406269 0.653531 As\n0.546880 0.210768 0.964699 As\n0.453119 0.789232 0.035301 As\n",
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{
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"structure_string": "K2 Al2 H4 C2 O10\n1.0\n3.099975 5.997269 -0.000000\n-3.099975 5.997269 -0.000000\n0.000000 0.000000 5.668112\nK Al H C O\n2 2 4 2 10\ndirect\n0.341492 0.341492 0.750000 K\n0.658509 0.658509 0.250000 K\n0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.213875 0.625580 0.250000 H\n0.374420 0.786125 0.750000 H\n0.786125 0.374420 0.750000 H\n0.625580 0.213875 0.250000 H\n0.786864 0.786864 0.750000 C\n0.213136 0.213136 0.250000 C\n0.320126 0.320126 0.250000 O\n0.784159 0.190317 0.250000 O\n0.809683 0.215841 0.750000 O\n0.215841 0.809683 0.750000 O\n0.190317 0.784159 0.250000 O\n0.159490 0.159490 0.450545 O\n0.840510 0.840510 0.549454 O\n0.159490 0.159490 0.049454 O\n0.840510 0.840510 0.950545 O\n0.679874 0.679874 0.750000 O\n",
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{
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"created_at": "2022-09-04T14:36:03.938311Z",
"updated_at": "2022-09-04T14:36:03.938342Z",
"structure_string": "Ho8 Sn4 Au8\n1.0\n7.888538 0.000000 0.000000\n-0.000000 7.888538 0.000000\n0.000000 0.000000 7.438532\nHo Sn Au\n8 4 8\ndirect\n0.340454 0.340454 0.000000 Ho\n0.659547 0.659547 0.000000 Ho\n0.840454 0.159547 0.500000 Ho\n0.159547 0.840454 0.500000 Ho\n0.820370 0.179631 0.000000 Ho\n0.179631 0.820370 0.000000 Ho\n0.679631 0.679631 0.500000 Ho\n0.320370 0.320370 0.500000 Ho\n0.000000 0.500000 0.750000 Sn\n0.000000 0.500000 0.250000 Sn\n0.500000 0.000000 0.750000 Sn\n0.500000 0.000000 0.250000 Sn\n0.128252 0.128252 0.229258 Au\n0.871748 0.871748 0.229258 Au\n0.628252 0.371748 0.729258 Au\n0.371748 0.628252 0.729258 Au\n0.628252 0.371748 0.270741 Au\n0.371748 0.628252 0.270741 Au\n0.128252 0.128252 0.770741 Au\n0.871748 0.871748 0.770741 Au\n",
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{
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"created_at": "2022-09-04T14:36:04.018423Z",
"updated_at": "2022-09-04T14:36:04.018446Z",
"structure_string": "La4 Mn4 O12\n1.0\n5.547815 0.000000 0.000000\n-0.000000 5.546901 0.000000\n0.000000 0.000000 7.825193\nLa Mn O\n4 4 12\ndirect\n0.005709 0.969342 0.750000 La\n0.494290 0.469343 0.750000 La\n0.505709 0.530657 0.250000 La\n0.994290 0.030657 0.250000 La\n0.500000 0.000000 0.500000 Mn\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.000000 Mn\n0.000000 0.500000 0.000000 Mn\n0.780708 0.781541 0.036858 O\n0.719291 0.281541 0.463142 O\n0.719291 0.281541 0.036858 O\n0.569040 0.010888 0.750000 O\n0.430959 0.989112 0.250000 O\n0.219291 0.218459 0.963141 O\n0.280708 0.718459 0.536858 O\n0.219291 0.218459 0.536858 O\n0.780708 0.781541 0.463142 O\n0.069040 0.489112 0.250000 O\n0.280708 0.718459 0.963141 O\n0.930959 0.510888 0.750000 O\n",
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{
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"structure_string": "Hg4 C8 N8\n1.0\n7.707745 -0.028976 -2.377662\n-4.205397 6.459475 -2.377662\n0.015782 0.028976 8.066125\nHg C N\n4 8 8\ndirect\n0.375000 0.321758 0.446758 Hg\n0.678242 0.125000 0.053242 Hg\n0.071758 0.625000 0.946758 Hg\n0.875000 0.928241 0.553241 Hg\n0.213193 0.360152 0.228260 C\n0.734933 0.381892 0.271740 C\n0.618107 0.889847 0.353041 C\n0.110152 0.463194 0.728260 C\n0.131892 0.984933 0.771739 C\n0.639847 0.868107 0.853041 C\n0.015066 0.786806 0.146959 C\n0.536807 0.265066 0.646959 C\n-0.002526 0.888916 0.267602 N\n0.621315 0.729872 0.732398 N\n0.128685 0.361083 0.608557 N\n0.638917 0.247474 0.767602 N\n0.270128 0.002526 0.891442 N\n0.752525 0.520127 0.391442 N\n0.111083 0.378685 0.108557 N\n0.479872 0.871314 0.232398 N\n",
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{
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"structure_string": "Li6 Fe2 F12\n1.0\n2.485067 -4.304262 -0.000000\n2.485067 4.304262 -0.000000\n-0.000000 -0.000000 9.203036\nLi Fe F\n6 2 12\ndirect\n0.666667 0.333334 0.042759 Li\n0.666667 0.333334 0.750000 Li\n0.333334 0.666667 0.250000 Li\n0.333334 0.666667 0.957241 Li\n0.333334 0.666667 0.542760 Li\n0.666667 0.333334 0.457241 Li\n0.000000 0.000000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.027731 0.696422 0.111266 F\n0.972270 0.668692 0.611266 F\n0.303579 0.331309 0.111266 F\n0.331309 0.303579 0.611266 F\n0.303579 0.972270 0.388734 F\n0.696422 0.027731 0.611266 F\n0.027731 0.331309 0.388734 F\n0.972270 0.303579 0.888734 F\n0.668692 0.696422 0.388734 F\n0.668692 0.972270 0.111266 F\n0.331309 0.027731 0.888734 F\n0.696422 0.668692 0.888734 F\n",
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"created_at": "2022-09-04T14:36:03.871328Z",
"updated_at": "2022-09-04T14:36:03.871356Z",
"structure_string": "La4 Ga4 O12\n1.0\n5.520754 -0.000000 0.000000\n0.000000 5.589182 0.000000\n0.000000 0.000000 7.821904\nLa Ga O\n4 4 12\ndirect\n0.999782 0.992601 0.750000 La\n0.500217 0.492601 0.250000 La\n0.000217 0.007398 0.250000 La\n0.499782 0.507398 0.750000 La\n0.000000 0.500000 0.500000 Ga\n0.500000 0.000000 0.500000 Ga\n0.500000 0.000000 0.000000 Ga\n0.000000 0.500000 0.000000 Ga\n0.749500 0.749494 0.543256 O\n0.750499 0.249494 0.456744 O\n0.499744 0.921380 0.250000 O\n0.999743 0.578620 0.250000 O\n0.500256 0.078620 0.750000 O\n0.249501 0.750505 0.543256 O\n0.750499 0.249494 0.043256 O\n0.749500 0.749494 0.956744 O\n0.250499 0.250506 0.456744 O\n0.249501 0.750505 0.956744 O\n0.250499 0.250506 0.043256 O\n0.000256 0.421380 0.750000 O\n",
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"structure_string": "Li5 Ti2 V3 O10\n1.0\n5.096644 -0.002556 -0.003528\n0.837148 4.954178 0.017052\n2.421296 2.056504 7.013964\nLi Ti V O\n5 2 3 10\ndirect\n0.497623 0.777955 0.414186 Li\n0.522506 0.597237 0.778239 Li\n0.996894 0.503586 0.501102 Li\n0.497138 0.220694 0.591165 Li\n0.473423 0.401137 0.228418 Li\n0.005002 0.895601 0.699912 Ti\n0.989866 0.109939 0.302946 Ti\n0.484408 -0.002668 0.006817 V\n0.998019 0.682054 0.095763 V\n0.996494 0.322336 0.910037 V\n0.223665 0.137990 0.456543 O\n0.237182 0.964119 0.853691 O\n0.768416 0.866042 0.548594 O\n0.732544 0.659936 0.945938 O\n0.231192 0.755705 0.248912 O\n0.237334 0.558786 0.664228 O\n0.752723 0.444141 0.343027 O\n0.758855 0.234944 0.767087 O\n0.261285 0.346322 0.056787 O\n0.754709 0.043433 0.147557 O\n",
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}