{"count":1013513,"next":"https://simmate.org/third-parties/OqmdStructure/?format=json&ordering=-nsites&page=5","previous":"https://simmate.org/third-parties/OqmdStructure/?format=json&ordering=-nsites&page=3","results":[{"id":"oqmd-31721","created_at":"2022-09-04T14:49:00.869477Z","updated_at":"2022-09-04T14:49:00.869505Z","structure_string":"Mg149 Br1\n1.0\n13.803647 -7.969543 0.000000\n0.000000 15.939087 0.000000\n0.000000 0.000000 15.637416\nBr Mg\n1 149\ndirect\n0.000000 0.000000 0.000000 Br\n0.204426 0.000960 0.000000 Mg\n0.796534 0.000960 0.000000 Mg\n0.400744 0.200372 0.000000 Mg\n0.799628 0.200372 0.000000 Mg\n0.600299 0.200599 0.000000 Mg\n0.204426 0.203466 0.000000 Mg\n0.999040 0.203466 0.000000 Mg\n0.600299 0.399700 0.000000 Mg\n0.799401 0.399701 0.000000 Mg\n0.199861 0.399721 0.000000 Mg\n0.401257 0.401791 0.000000 Mg\n0.000534 0.401791 0.000000 Mg\n0.598209 0.598743 0.000000 Mg\n0.000534 0.598743 0.000000 Mg\n0.799628 0.599256 0.000000 Mg\n0.200621 0.600310 0.000000 Mg\n0.399689 0.600310 0.000000 Mg\n0.796534 0.795574 0.000000 Mg\n0.999040 0.795574 0.000000 Mg\n0.399689 0.799379 0.000000 Mg\n0.600279 0.800139 0.000000 Mg\n0.199861 0.800139 0.000000 Mg\n0.598209 0.999467 0.000000 Mg\n0.401257 0.999467 0.000000 Mg\n0.666667 0.333333 0.166161 Mg\n0.466324 0.133105 0.166260 Mg\n0.666781 0.133105 0.166260 Mg\n0.466324 0.333219 0.166260 Mg\n0.866896 0.333219 0.166260 Mg\n0.666781 0.533676 0.166260 Mg\n0.866896 0.533676 0.166260 Mg\n0.266572 0.533144 0.166474 Mg\n0.466856 0.733428 0.166474 Mg\n0.266572 0.733428 0.166474 Mg\n0.266820 0.333316 0.166657 Mg\n0.066496 0.333316 0.166657 Mg\n0.666684 0.733180 0.166657 Mg\n0.066496 0.733180 0.166657 Mg\n0.666684 0.933504 0.166657 Mg\n0.266820 0.933504 0.166657 Mg\n0.867197 0.132803 0.166925 Mg\n0.265606 0.132803 0.166925 Mg\n0.867197 0.734394 0.166925 Mg\n0.466567 0.533433 0.167046 Mg\n0.066866 0.533433 0.167046 Mg\n0.466567 0.933134 0.167046 Mg\n0.067762 0.135524 0.170096 Mg\n0.864476 0.932238 0.170096 Mg\n0.067762 0.932238 0.170096 Mg\n0.000000 0.000000 0.332075 Mg\n0.800039 0.199961 0.332882 Mg\n0.399923 0.199961 0.332882 Mg\n0.800039 0.600078 0.332882 Mg\n0.600036 0.200072 0.332988 Mg\n0.799928 0.399964 0.332988 Mg\n0.600036 0.399964 0.332988 Mg\n0.199860 0.399719 0.333005 Mg\n0.199860 0.800140 0.333005 Mg\n0.600280 0.800140 0.333005 Mg\n0.200029 0.600014 0.333285 Mg\n0.399986 0.600014 0.333285 Mg\n0.399986 0.799971 0.333285 Mg\n0.400194 0.000000 0.333394 Mg\n0.599881 0.000000 0.333394 Mg\n0.400194 0.400119 0.333394 Mg\n0.000000 0.400119 0.333394 Mg\n0.599881 0.599807 0.333394 Mg\n0.000000 0.599807 0.333394 Mg\n0.799537 0.000000 0.334503 Mg\n0.200529 0.000000 0.334503 Mg\n0.200529 0.200463 0.334503 Mg\n0.000000 0.200463 0.334503 Mg\n0.799537 0.799471 0.334503 Mg\n0.000000 0.799471 0.334503 Mg\n0.066560 0.133120 0.500000 Mg\n0.266995 0.133497 0.500000 Mg\n0.866503 0.133498 0.500000 Mg\n0.466846 0.133570 0.500000 Mg\n0.666724 0.133570 0.500000 Mg\n0.466846 0.333276 0.500000 Mg\n0.866430 0.333277 0.500000 Mg\n0.666667 0.333333 0.500000 Mg\n0.066854 0.333570 0.500000 Mg\n0.266716 0.333570 0.500000 Mg\n0.666724 0.533154 0.500000 Mg\n0.866430 0.533154 0.500000 Mg\n0.066830 0.533415 0.500000 Mg\n0.466585 0.533415 0.500000 Mg\n0.266766 0.533532 0.500000 Mg\n0.866503 0.733005 0.500000 Mg\n0.466468 0.733234 0.500000 Mg\n0.266766 0.733234 0.500000 Mg\n0.666430 0.733284 0.500000 Mg\n0.066854 0.733284 0.500000 Mg\n0.266716 0.933146 0.500000 Mg\n0.666430 0.933146 0.500000 Mg\n0.466585 0.933170 0.500000 Mg\n0.866880 0.933440 0.500000 Mg\n0.066560 0.933440 0.500000 Mg\n0.799537 0.000000 0.665496 Mg\n0.200529 0.000000 0.665496 Mg\n0.200529 0.200463 0.665496 Mg\n0.000000 0.200463 0.665496 Mg\n0.799537 0.799471 0.665496 Mg\n0.000000 0.799471 0.665496 Mg\n0.400194 0.000000 0.666606 Mg\n0.599881 0.000000 0.666606 Mg\n0.400194 0.400119 0.666606 Mg\n0.000000 0.400119 0.666606 Mg\n0.599881 0.599807 0.666606 Mg\n0.000000 0.599807 0.666606 Mg\n0.200029 0.600014 0.666714 Mg\n0.399986 0.600014 0.666714 Mg\n0.399986 0.799971 0.666714 Mg\n0.199860 0.399719 0.666995 Mg\n0.199860 0.800140 0.666995 Mg\n0.600280 0.800140 0.666995 Mg\n0.600036 0.200072 0.667012 Mg\n0.799928 0.399964 0.667012 Mg\n0.600036 0.399964 0.667012 Mg\n0.800039 0.199961 0.667118 Mg\n0.399923 0.199961 0.667118 Mg\n0.800039 0.600078 0.667118 Mg\n0.000000 0.000000 0.667924 Mg\n0.067762 0.135524 0.829904 Mg\n0.864476 0.932238 0.829904 Mg\n0.067762 0.932238 0.829904 Mg\n0.466567 0.533433 0.832955 Mg\n0.066866 0.533433 0.832955 Mg\n0.466567 0.933134 0.832955 Mg\n0.867197 0.132803 0.833075 Mg\n0.265606 0.132803 0.833075 Mg\n0.867197 0.734394 0.833075 Mg\n0.266820 0.333316 0.833344 Mg\n0.066496 0.333316 0.833344 Mg\n0.666684 0.733180 0.833344 Mg\n0.066496 0.733180 0.833344 Mg\n0.666684 0.933504 0.833344 Mg\n0.266820 0.933504 0.833344 Mg\n0.266572 0.533144 0.833526 Mg\n0.466856 0.733428 0.833526 Mg\n0.266572 0.733428 0.833526 Mg\n0.466324 0.133105 0.833741 Mg\n0.666781 0.133105 0.833741 Mg\n0.466324 0.333219 0.833741 Mg\n0.866896 0.333219 0.833741 Mg\n0.666781 0.533676 0.833741 Mg\n0.866896 0.533676 0.833741 Mg\n0.666667 0.333333 0.833839 Mg\n","nsites":150,"nelements":2,"elements":["Br","Mg"],"chemical_system":"Br-Mg","density":1.7864335179727848,"density_atomic":0.043598242589385196,"volume":3440.5056509438364,"volume_molar":13.812806210372806,"formula_full":"Mg149 Br1","formula_reduced":"Mg149Br","formula_anonymous":"AB149","formation_energy":-0.0035993269549978,"spacegroup":187},{"id":"oqmd-31747","created_at":"2022-09-04T14:49:00.988886Z","updated_at":"2022-09-04T14:49:00.988914Z","structure_string":"La1 Mg149\n1.0\n13.833592 -7.986832 0.000000\n0.000000 15.973664 0.000000\n0.000000 0.000000 15.631812\nLa Mg\n1 149\ndirect\n0.000000 0.000000 0.000000 La\n0.600018 0.200037 0.000000 Mg\n0.401650 0.200825 0.000000 Mg\n0.799175 0.200825 0.000000 Mg\n0.204072 0.207867 0.000000 Mg\n0.003796 0.207868 0.000000 Mg\n0.799964 0.399982 0.000000 Mg\n0.600018 0.399982 0.000000 Mg\n0.000263 0.400951 0.000000 Mg\n0.400688 0.400951 0.000000 Mg\n0.201983 0.403966 0.000000 Mg\n0.799175 0.598350 0.000000 Mg\n0.000263 0.599312 0.000000 Mg\n0.599049 0.599312 0.000000 Mg\n0.399666 0.600334 0.000000 Mg\n0.200669 0.600334 0.000000 Mg\n0.792133 0.795928 0.000000 Mg\n0.003796 0.795929 0.000000 Mg\n0.596034 0.798017 0.000000 Mg\n0.201983 0.798017 0.000000 Mg\n0.399666 0.799331 0.000000 Mg\n0.792133 0.996204 0.000000 Mg\n0.204072 0.996205 0.000000 Mg\n0.599049 0.999736 0.000000 Mg\n0.400688 0.999737 0.000000 Mg\n0.868872 0.131127 0.164094 Mg\n0.262256 0.131128 0.164094 Mg\n0.868872 0.737745 0.164094 Mg\n0.666667 0.333334 0.166259 Mg\n0.465252 0.132716 0.166455 Mg\n0.667464 0.132716 0.166455 Mg\n0.867284 0.332535 0.166455 Mg\n0.465252 0.332536 0.166455 Mg\n0.667464 0.534748 0.166455 Mg\n0.867284 0.534748 0.166455 Mg\n0.066654 0.533327 0.167355 Mg\n0.466673 0.533328 0.167355 Mg\n0.466673 0.933345 0.167355 Mg\n0.267231 0.534463 0.167437 Mg\n0.267231 0.732768 0.167437 Mg\n0.465537 0.732768 0.167437 Mg\n0.068076 0.336511 0.167947 Mg\n0.268435 0.336511 0.167947 Mg\n0.068076 0.731565 0.167947 Mg\n0.663489 0.731565 0.167947 Mg\n0.268435 0.931924 0.167947 Mg\n0.663489 0.931924 0.167947 Mg\n0.068833 0.137666 0.171748 Mg\n0.862334 0.931167 0.171748 Mg\n0.068833 0.931167 0.171748 Mg\n0.399787 0.199893 0.332733 Mg\n0.800107 0.199894 0.332733 Mg\n0.800107 0.600213 0.332733 Mg\n0.600080 0.200160 0.332891 Mg\n0.600080 0.399920 0.332891 Mg\n0.799840 0.399920 0.332891 Mg\n0.400546 0.000204 0.333776 Mg\n0.599658 0.000204 0.333776 Mg\n0.400546 0.400342 0.333776 Mg\n0.999797 0.400343 0.333776 Mg\n0.599658 0.599454 0.333776 Mg\n0.999797 0.599454 0.333776 Mg\n0.200098 0.600049 0.333841 Mg\n0.399951 0.600050 0.333841 Mg\n0.399951 0.799902 0.333841 Mg\n0.200978 0.000218 0.334107 Mg\n0.799240 0.000218 0.334107 Mg\n0.200978 0.200760 0.334107 Mg\n0.999782 0.200761 0.334107 Mg\n0.999782 0.799022 0.334107 Mg\n0.799240 0.799022 0.334107 Mg\n0.200289 0.400577 0.334128 Mg\n0.200289 0.799711 0.334128 Mg\n0.599423 0.799712 0.334128 Mg\n0.000000 0.000000 0.334472 Mg\n0.866497 0.133502 0.500000 Mg\n0.267005 0.133503 0.500000 Mg\n0.066778 0.133556 0.500000 Mg\n0.667109 0.134243 0.500000 Mg\n0.467133 0.134243 0.500000 Mg\n0.467133 0.332890 0.500000 Mg\n0.865757 0.332890 0.500000 Mg\n0.666667 0.333334 0.500000 Mg\n0.266946 0.333739 0.500000 Mg\n0.066793 0.333739 0.500000 Mg\n0.667109 0.532867 0.500000 Mg\n0.865757 0.532867 0.500000 Mg\n0.066337 0.533168 0.500000 Mg\n0.466832 0.533169 0.500000 Mg\n0.266781 0.533562 0.500000 Mg\n0.866497 0.732995 0.500000 Mg\n0.666261 0.733054 0.500000 Mg\n0.066793 0.733054 0.500000 Mg\n0.266781 0.733218 0.500000 Mg\n0.466438 0.733219 0.500000 Mg\n0.266946 0.933207 0.500000 Mg\n0.666261 0.933207 0.500000 Mg\n0.066778 0.933221 0.500000 Mg\n0.866443 0.933221 0.500000 Mg\n0.466832 0.933663 0.500000 Mg\n0.000000 0.000000 0.665527 Mg\n0.200289 0.400577 0.665872 Mg\n0.200289 0.799711 0.665872 Mg\n0.599423 0.799712 0.665872 Mg\n0.200978 0.000218 0.665893 Mg\n0.799240 0.000218 0.665893 Mg\n0.200978 0.200760 0.665893 Mg\n0.999782 0.200761 0.665893 Mg\n0.999782 0.799022 0.665893 Mg\n0.799240 0.799022 0.665893 Mg\n0.200098 0.600049 0.666159 Mg\n0.399951 0.600050 0.666159 Mg\n0.399951 0.799902 0.666159 Mg\n0.400546 0.000204 0.666223 Mg\n0.599658 0.000204 0.666223 Mg\n0.400546 0.400342 0.666223 Mg\n0.999797 0.400343 0.666223 Mg\n0.599658 0.599454 0.666223 Mg\n0.999797 0.599454 0.666223 Mg\n0.600080 0.200160 0.667109 Mg\n0.600080 0.399920 0.667109 Mg\n0.799840 0.399920 0.667109 Mg\n0.399787 0.199893 0.667267 Mg\n0.800107 0.199894 0.667267 Mg\n0.800107 0.600213 0.667267 Mg\n0.068833 0.137666 0.828251 Mg\n0.862334 0.931167 0.828251 Mg\n0.068833 0.931167 0.828251 Mg\n0.068076 0.336511 0.832053 Mg\n0.268435 0.336511 0.832053 Mg\n0.068076 0.731565 0.832053 Mg\n0.663489 0.731565 0.832053 Mg\n0.268435 0.931924 0.832053 Mg\n0.663489 0.931924 0.832053 Mg\n0.267231 0.534463 0.832562 Mg\n0.267231 0.732768 0.832562 Mg\n0.465537 0.732768 0.832562 Mg\n0.066654 0.533327 0.832646 Mg\n0.466673 0.533328 0.832646 Mg\n0.466673 0.933345 0.832646 Mg\n0.465252 0.132716 0.833545 Mg\n0.667464 0.132716 0.833545 Mg\n0.867284 0.332535 0.833545 Mg\n0.465252 0.332536 0.833545 Mg\n0.667464 0.534748 0.833545 Mg\n0.867284 0.534748 0.833545 Mg\n0.666667 0.333334 0.833741 Mg\n0.868872 0.131127 0.835906 Mg\n0.262256 0.131128 0.835906 Mg\n0.868872 0.737745 0.835906 Mg\n","nsites":150,"nelements":2,"elements":["La","Mg"],"chemical_system":"La-Mg","density":1.807709291271684,"density_atomic":0.043425260075399236,"volume":3454.210745993349,"volume_molar":13.867828884717703,"formula_full":"La1 Mg149","formula_reduced":"LaMg149","formula_anonymous":"AB149","formation_energy":0.0013241632944412,"spacegroup":187},{"id":"oqmd-31724","created_at":"2022-09-04T14:49:00.927147Z","updated_at":"2022-09-04T14:49:00.927172Z","structure_string":"Mg149 Cd1\n1.0\n13.771522 -7.950996 0.000000\n0.000000 15.901991 0.000000\n0.000000 0.000000 15.624136\nCd Mg\n1 149\ndirect\n0.000000 0.000000 0.000000 Cd\n0.199418 0.000610 0.000000 Mg\n0.801192 0.000610 0.000000 Mg\n0.199418 0.198808 0.000000 Mg\n0.999390 0.198808 0.000000 Mg\n0.399617 0.199808 0.000000 Mg\n0.800192 0.199808 0.000000 Mg\n0.599962 0.199924 0.000000 Mg\n0.199584 0.399169 0.000000 Mg\n0.399867 0.399946 0.000000 Mg\n0.000000 0.399947 0.000000 Mg\n0.599962 0.400038 0.000000 Mg\n0.800076 0.400038 0.000000 Mg\n0.400056 0.599944 0.000000 Mg\n0.199888 0.599944 0.000000 Mg\n0.000000 0.600132 0.000000 Mg\n0.600054 0.600133 0.000000 Mg\n0.800192 0.600383 0.000000 Mg\n0.400056 0.800112 0.000000 Mg\n0.199584 0.800415 0.000000 Mg\n0.600831 0.800416 0.000000 Mg\n0.999390 0.800581 0.000000 Mg\n0.801192 0.800582 0.000000 Mg\n0.399867 0.000000 0.000000 Mg\n0.600054 0.000000 0.000000 Mg\n0.066397 0.132794 0.166005 Mg\n0.867206 0.933603 0.166005 Mg\n0.066397 0.933603 0.166005 Mg\n0.266273 0.332727 0.166426 Mg\n0.066455 0.332727 0.166426 Mg\n0.066455 0.733727 0.166426 Mg\n0.667273 0.733727 0.166426 Mg\n0.667273 0.933546 0.166426 Mg\n0.266273 0.933546 0.166426 Mg\n0.466781 0.133345 0.166566 Mg\n0.666564 0.133345 0.166566 Mg\n0.466781 0.333436 0.166566 Mg\n0.866655 0.333436 0.166566 Mg\n0.666564 0.533219 0.166566 Mg\n0.866655 0.533219 0.166566 Mg\n0.666666 0.333333 0.166580 Mg\n0.466627 0.533372 0.166628 Mg\n0.066745 0.533373 0.166628 Mg\n0.466627 0.933255 0.166628 Mg\n0.266554 0.533110 0.166704 Mg\n0.266554 0.733445 0.166704 Mg\n0.466890 0.733445 0.166704 Mg\n0.866348 0.133652 0.167193 Mg\n0.267304 0.133652 0.167193 Mg\n0.866348 0.732696 0.167193 Mg\n0.000000 0.000000 0.332905 Mg\n0.000000 0.199902 0.333224 Mg\n0.199852 0.199902 0.333224 Mg\n0.800098 0.800148 0.333224 Mg\n0.000000 0.800148 0.333224 Mg\n0.199852 0.000000 0.333224 Mg\n0.800098 0.000000 0.333224 Mg\n0.399882 0.000000 0.333235 Mg\n0.600168 0.000000 0.333235 Mg\n0.000000 0.399832 0.333235 Mg\n0.399882 0.399833 0.333235 Mg\n0.000000 0.600117 0.333235 Mg\n0.600168 0.600117 0.333235 Mg\n0.199953 0.399906 0.333245 Mg\n0.199953 0.800047 0.333245 Mg\n0.600093 0.800047 0.333245 Mg\n0.600008 0.200016 0.333274 Mg\n0.600008 0.399992 0.333274 Mg\n0.799984 0.399992 0.333274 Mg\n0.799979 0.200021 0.333385 Mg\n0.400042 0.200021 0.333385 Mg\n0.799979 0.599958 0.333385 Mg\n0.400009 0.599991 0.333444 Mg\n0.199983 0.599992 0.333444 Mg\n0.400009 0.800017 0.333444 Mg\n0.066608 0.133216 0.500000 Mg\n0.866684 0.133316 0.500000 Mg\n0.266631 0.133316 0.500000 Mg\n0.466744 0.133348 0.500000 Mg\n0.666605 0.133348 0.500000 Mg\n0.266690 0.333276 0.500000 Mg\n0.066586 0.333276 0.500000 Mg\n0.666666 0.333333 0.500000 Mg\n0.866652 0.333395 0.500000 Mg\n0.466744 0.333396 0.500000 Mg\n0.866652 0.533256 0.500000 Mg\n0.666605 0.533257 0.500000 Mg\n0.466722 0.533278 0.500000 Mg\n0.066557 0.533279 0.500000 Mg\n0.266648 0.533297 0.500000 Mg\n0.066586 0.733310 0.500000 Mg\n0.666724 0.733310 0.500000 Mg\n0.266648 0.733351 0.500000 Mg\n0.466704 0.733352 0.500000 Mg\n0.866684 0.733368 0.500000 Mg\n0.866784 0.933392 0.500000 Mg\n0.066608 0.933392 0.500000 Mg\n0.666724 0.933414 0.500000 Mg\n0.266690 0.933414 0.500000 Mg\n0.466722 0.933444 0.500000 Mg\n0.400009 0.599991 0.666556 Mg\n0.199983 0.599992 0.666556 Mg\n0.400009 0.800017 0.666556 Mg\n0.799979 0.200021 0.666615 Mg\n0.400042 0.200021 0.666615 Mg\n0.799979 0.599958 0.666615 Mg\n0.600008 0.200016 0.666726 Mg\n0.600008 0.399992 0.666726 Mg\n0.799984 0.399992 0.666726 Mg\n0.199953 0.399906 0.666754 Mg\n0.199953 0.800047 0.666754 Mg\n0.600093 0.800047 0.666754 Mg\n0.399882 0.000000 0.666765 Mg\n0.600168 0.000000 0.666765 Mg\n0.000000 0.399832 0.666765 Mg\n0.399882 0.399833 0.666765 Mg\n0.000000 0.600117 0.666765 Mg\n0.600168 0.600117 0.666765 Mg\n0.000000 0.199902 0.666776 Mg\n0.199852 0.199902 0.666776 Mg\n0.800098 0.800148 0.666776 Mg\n0.000000 0.800148 0.666776 Mg\n0.199852 0.000000 0.666776 Mg\n0.800098 0.000000 0.666776 Mg\n0.000000 0.000000 0.667095 Mg\n0.866348 0.133652 0.832807 Mg\n0.267304 0.133652 0.832807 Mg\n0.866348 0.732696 0.832807 Mg\n0.266554 0.533110 0.833296 Mg\n0.266554 0.733445 0.833296 Mg\n0.466890 0.733445 0.833296 Mg\n0.466627 0.533372 0.833372 Mg\n0.066745 0.533373 0.833372 Mg\n0.466627 0.933255 0.833372 Mg\n0.666666 0.333333 0.833420 Mg\n0.466781 0.133345 0.833434 Mg\n0.666564 0.133345 0.833434 Mg\n0.466781 0.333436 0.833434 Mg\n0.866655 0.333436 0.833434 Mg\n0.666564 0.533219 0.833434 Mg\n0.866655 0.533219 0.833434 Mg\n0.266273 0.332727 0.833574 Mg\n0.066455 0.332727 0.833574 Mg\n0.066455 0.733727 0.833574 Mg\n0.667273 0.733727 0.833574 Mg\n0.667273 0.933546 0.833574 Mg\n0.266273 0.933546 0.833574 Mg\n0.066397 0.132794 0.833995 Mg\n0.867206 0.933603 0.833995 Mg\n0.066397 0.933603 0.833995 Mg\n","nsites":150,"nelements":2,"elements":["Cd","Mg"],"chemical_system":"Cd-Mg","density":1.812079337232858,"density_atomic":0.043839117687753386,"volume":3421.601708966489,"volume_molar":13.736911410701833,"formula_full":"Mg149 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0.799451 0.000000 Mg\n0.199769 0.800231 0.000000 Mg\n0.600461 0.800231 0.000000 Mg\n0.598672 0.999491 0.000000 Mg\n0.400819 0.999491 0.000000 Mg\n0.666667 0.333333 0.166162 Mg\n0.666836 0.133088 0.166273 Mg\n0.466252 0.133088 0.166273 Mg\n0.466252 0.333164 0.166273 Mg\n0.866912 0.333164 0.166273 Mg\n0.866912 0.533748 0.166273 Mg\n0.666836 0.533748 0.166273 Mg\n0.266567 0.533134 0.166472 Mg\n0.266567 0.733433 0.166472 Mg\n0.466866 0.733433 0.166472 Mg\n0.066523 0.333137 0.166569 Mg\n0.266615 0.333138 0.166569 Mg\n0.666862 0.733385 0.166569 Mg\n0.066523 0.733385 0.166569 Mg\n0.666862 0.933477 0.166569 Mg\n0.266615 0.933477 0.166569 Mg\n0.265501 0.132750 0.166742 Mg\n0.867250 0.132751 0.166742 Mg\n0.867250 0.734499 0.166742 Mg\n0.466587 0.533413 0.166988 Mg\n0.066827 0.533414 0.166988 Mg\n0.466587 0.933173 0.166988 Mg\n0.067198 0.134396 0.168487 Mg\n0.865604 0.932802 0.168487 Mg\n0.067198 0.932802 0.168487 Mg\n0.000000 0.000000 0.331605 Mg\n0.399802 0.199901 0.332863 Mg\n0.800099 0.199901 0.332863 Mg\n0.800099 0.600198 0.332863 Mg\n0.600025 0.200050 0.332966 Mg\n0.600025 0.399974 0.332966 Mg\n0.799949 0.399975 0.332966 Mg\n0.199904 0.399808 0.333036 Mg\n0.199904 0.800096 0.333036 Mg\n0.600192 0.800096 0.333036 Mg\n0.399978 0.600022 0.333324 Mg\n0.200045 0.600023 0.333324 Mg\n0.399978 0.799956 0.333324 Mg\n0.400119 0.000000 0.333347 Mg\n0.599933 0.000000 0.333347 Mg\n0.000000 0.400067 0.333347 Mg\n0.400119 0.400067 0.333347 Mg\n0.599933 0.599881 0.333347 Mg\n0.000000 0.599882 0.333347 Mg\n0.000000 0.200349 0.334130 Mg\n0.200286 0.200349 0.334130 Mg\n0.799651 0.799714 0.334130 Mg\n0.000000 0.799715 0.334130 Mg\n0.200286 0.000000 0.334130 Mg\n0.799651 0.000000 0.334130 Mg\n0.066543 0.133085 0.500000 Mg\n0.866546 0.133453 0.500000 Mg\n0.266906 0.133453 0.500000 Mg\n0.666741 0.133627 0.500000 Mg\n0.466886 0.133627 0.500000 Mg\n0.866373 0.333259 0.500000 Mg\n0.466886 0.333259 0.500000 Mg\n0.666667 0.333333 0.500000 Mg\n0.066785 0.333446 0.500000 Mg\n0.266661 0.333446 0.500000 Mg\n0.866373 0.533114 0.500000 Mg\n0.666741 0.533114 0.500000 Mg\n0.466620 0.533380 0.500000 Mg\n0.066760 0.533380 0.500000 Mg\n0.266767 0.533533 0.500000 Mg\n0.866546 0.733093 0.500000 Mg\n0.266767 0.733233 0.500000 Mg\n0.466466 0.733233 0.500000 Mg\n0.666554 0.733338 0.500000 Mg\n0.066785 0.733339 0.500000 Mg\n0.266661 0.933215 0.500000 Mg\n0.666554 0.933215 0.500000 Mg\n0.466620 0.933240 0.500000 Mg\n0.066543 0.933457 0.500000 Mg\n0.866915 0.933458 0.500000 Mg\n0.000000 0.200349 0.665870 Mg\n0.200286 0.200349 0.665870 Mg\n0.799651 0.799714 0.665870 Mg\n0.000000 0.799715 0.665870 Mg\n0.200286 0.000000 0.665870 Mg\n0.799651 0.000000 0.665870 Mg\n0.400119 0.000000 0.666653 Mg\n0.599933 0.000000 0.666653 Mg\n0.000000 0.400067 0.666653 Mg\n0.400119 0.400067 0.666653 Mg\n0.599933 0.599881 0.666653 Mg\n0.000000 0.599882 0.666653 Mg\n0.399978 0.600022 0.666676 Mg\n0.200045 0.600023 0.666676 Mg\n0.399978 0.799956 0.666676 Mg\n0.199904 0.399808 0.666963 Mg\n0.199904 0.800096 0.666963 Mg\n0.600192 0.800096 0.666963 Mg\n0.600025 0.200050 0.667035 Mg\n0.600025 0.399974 0.667035 Mg\n0.799949 0.399975 0.667035 Mg\n0.399802 0.199901 0.667137 Mg\n0.800099 0.199901 0.667137 Mg\n0.800099 0.600198 0.667137 Mg\n0.000000 0.000000 0.668395 Mg\n0.067198 0.134396 0.831513 Mg\n0.865604 0.932802 0.831513 Mg\n0.067198 0.932802 0.831513 Mg\n0.466587 0.533413 0.833012 Mg\n0.066827 0.533414 0.833012 Mg\n0.466587 0.933173 0.833012 Mg\n0.265501 0.132750 0.833257 Mg\n0.867250 0.132751 0.833257 Mg\n0.867250 0.734499 0.833257 Mg\n0.066523 0.333137 0.833431 Mg\n0.266615 0.333138 0.833431 Mg\n0.666862 0.733385 0.833431 Mg\n0.066523 0.733385 0.833431 Mg\n0.666862 0.933477 0.833431 Mg\n0.266615 0.933477 0.833431 Mg\n0.266567 0.533134 0.833528 Mg\n0.266567 0.733433 0.833528 Mg\n0.466866 0.733433 0.833528 Mg\n0.666836 0.133088 0.833727 Mg\n0.466252 0.133088 0.833727 Mg\n0.466252 0.333164 0.833727 Mg\n0.866912 0.333164 0.833727 Mg\n0.866912 0.533748 0.833727 Mg\n0.666836 0.533748 0.833727 Mg\n0.666667 0.333333 0.833838 Mg\n","nsites":150,"nelements":2,"elements":["Cl","Mg"],"chemical_system":"Cl-Mg","density":1.76959427641786,"density_atomic":0.04371223571601441,"volume":3431.533472103922,"volume_molar":13.776785061107569,"formula_full":"Mg149 Cl1","formula_reduced":"Mg149Cl","formula_anonymous":"AB149","formation_energy":-0.0063220309430196,"spacegroup":187},{"id":"oqmd-31732","created_at":"2022-09-04T14:49:00.687401Z","updated_at":"2022-09-04T14:49:00.687429Z","structure_string":"Er1 Mg149\n1.0\n13.811100 -7.973846 0.000000\n0.000000 15.947691 0.000000\n0.000000 0.000000 15.624756\nEr Mg\n1 149\ndirect\n0.000000 0.000000 0.000000 Er\n0.599890 0.199780 0.000000 Mg\n0.400975 0.200487 0.000000 Mg\n0.799513 0.200487 0.000000 Mg\n0.200905 0.203621 0.000000 Mg\n0.002716 0.203621 0.000000 Mg\n0.000133 0.399922 0.000000 Mg\n0.399789 0.399922 0.000000 Mg\n0.599890 0.400110 0.000000 Mg\n0.800220 0.400110 0.000000 Mg\n0.201357 0.402714 0.000000 Mg\n0.799513 0.599025 0.000000 Mg\n0.399819 0.600181 0.000000 Mg\n0.200362 0.600181 0.000000 Mg\n0.600078 0.600210 0.000000 Mg\n0.000133 0.600211 0.000000 Mg\n0.201357 0.798643 0.000000 Mg\n0.597286 0.798643 0.000000 Mg\n0.002716 0.799095 0.000000 Mg\n0.796379 0.799095 0.000000 Mg\n0.399819 0.799638 0.000000 Mg\n0.796379 0.997284 0.000000 Mg\n0.200905 0.997284 0.000000 Mg\n0.399789 0.999868 0.000000 Mg\n0.600078 0.999868 0.000000 Mg\n0.263811 0.131906 0.164833 Mg\n0.868095 0.131906 0.164833 Mg\n0.868095 0.736189 0.164833 Mg\n0.666667 0.333333 0.166289 Mg\n0.667272 0.132846 0.166505 Mg\n0.465574 0.132846 0.166505 Mg\n0.867154 0.332728 0.166505 Mg\n0.465574 0.332728 0.166505 Mg\n0.867154 0.534426 0.166505 Mg\n0.667272 0.534426 0.166505 Mg\n0.466705 0.533295 0.167149 Mg\n0.066590 0.533295 0.167149 Mg\n0.466705 0.933410 0.167149 Mg\n0.267083 0.534166 0.167377 Mg\n0.267083 0.732917 0.167377 Mg\n0.465833 0.732917 0.167377 Mg\n0.067778 0.335461 0.167548 Mg\n0.267683 0.335461 0.167548 Mg\n0.664539 0.732317 0.167548 Mg\n0.067778 0.732317 0.167548 Mg\n0.664539 0.932221 0.167548 Mg\n0.267683 0.932221 0.167548 Mg\n0.067407 0.134813 0.168588 Mg\n0.067407 0.932593 0.168588 Mg\n0.865187 0.932594 0.168588 Mg\n0.800088 0.199913 0.332941 Mg\n0.399826 0.199913 0.332941 Mg\n0.800088 0.600175 0.332941 Mg\n0.600056 0.200113 0.332952 Mg\n0.600056 0.399943 0.332952 Mg\n0.799887 0.399944 0.332952 Mg\n0.200363 0.000000 0.333345 Mg\n0.799651 0.000000 0.333345 Mg\n0.200363 0.200349 0.333345 Mg\n0.000000 0.200349 0.333345 Mg\n0.000000 0.799637 0.333345 Mg\n0.799651 0.799637 0.333345 Mg\n0.599854 0.000195 0.333655 Mg\n0.400342 0.000195 0.333655 Mg\n0.999805 0.400146 0.333655 Mg\n0.400342 0.400147 0.333655 Mg\n0.999805 0.599658 0.333655 Mg\n0.599854 0.599659 0.333655 Mg\n0.399996 0.600003 0.333854 Mg\n0.200007 0.600004 0.333854 Mg\n0.399996 0.799993 0.333854 Mg\n0.200275 0.400550 0.334073 Mg\n0.200275 0.799725 0.334073 Mg\n0.599450 0.799725 0.334073 Mg\n0.000000 0.000000 0.334444 Mg\n0.266875 0.133438 0.500000 Mg\n0.866562 0.133438 0.500000 Mg\n0.066780 0.133560 0.500000 Mg\n0.667034 0.134137 0.500000 Mg\n0.467103 0.134138 0.500000 Mg\n0.865862 0.332965 0.500000 Mg\n0.467103 0.332965 0.500000 Mg\n0.666667 0.333333 0.500000 Mg\n0.066671 0.333519 0.500000 Mg\n0.266848 0.333520 0.500000 Mg\n0.667034 0.532897 0.500000 Mg\n0.865862 0.532897 0.500000 Mg\n0.466864 0.533137 0.500000 Mg\n0.066273 0.533137 0.500000 Mg\n0.266730 0.533460 0.500000 Mg\n0.866562 0.733125 0.500000 Mg\n0.666481 0.733151 0.500000 Mg\n0.066671 0.733152 0.500000 Mg\n0.266730 0.733270 0.500000 Mg\n0.466540 0.733270 0.500000 Mg\n0.066780 0.933220 0.500000 Mg\n0.866440 0.933220 0.500000 Mg\n0.266848 0.933329 0.500000 Mg\n0.666481 0.933329 0.500000 Mg\n0.466864 0.933727 0.500000 Mg\n0.000000 0.000000 0.665556 Mg\n0.200275 0.400550 0.665927 Mg\n0.200275 0.799725 0.665927 Mg\n0.599450 0.799725 0.665927 Mg\n0.399996 0.600003 0.666147 Mg\n0.200007 0.600004 0.666147 Mg\n0.399996 0.799993 0.666147 Mg\n0.599854 0.000195 0.666344 Mg\n0.400342 0.000195 0.666344 Mg\n0.999805 0.400146 0.666344 Mg\n0.400342 0.400147 0.666344 Mg\n0.999805 0.599658 0.666344 Mg\n0.599854 0.599659 0.666344 Mg\n0.200363 0.000000 0.666656 Mg\n0.799651 0.000000 0.666656 Mg\n0.200363 0.200349 0.666656 Mg\n0.000000 0.200349 0.666656 Mg\n0.000000 0.799637 0.666656 Mg\n0.799651 0.799637 0.666656 Mg\n0.600056 0.200113 0.667048 Mg\n0.600056 0.399943 0.667048 Mg\n0.799887 0.399944 0.667048 Mg\n0.800088 0.199913 0.667059 Mg\n0.399826 0.199913 0.667059 Mg\n0.800088 0.600175 0.667059 Mg\n0.067407 0.134813 0.831412 Mg\n0.067407 0.932593 0.831412 Mg\n0.865187 0.932594 0.831412 Mg\n0.067778 0.335461 0.832452 Mg\n0.267683 0.335461 0.832452 Mg\n0.664539 0.732317 0.832452 Mg\n0.067778 0.732317 0.832452 Mg\n0.664539 0.932221 0.832452 Mg\n0.267683 0.932221 0.832452 Mg\n0.267083 0.534166 0.832624 Mg\n0.267083 0.732917 0.832624 Mg\n0.465833 0.732917 0.832624 Mg\n0.466705 0.533295 0.832851 Mg\n0.066590 0.533295 0.832851 Mg\n0.466705 0.933410 0.832851 Mg\n0.667272 0.132846 0.833495 Mg\n0.465574 0.132846 0.833495 Mg\n0.867154 0.332728 0.833495 Mg\n0.465574 0.332728 0.833495 Mg\n0.867154 0.534426 0.833495 Mg\n0.667272 0.534426 0.833495 Mg\n0.666667 0.333333 0.833711 Mg\n0.263811 0.131906 0.835168 Mg\n0.868095 0.131906 0.835168 Mg\n0.868095 0.736189 0.835168 Mg\n","nsites":150,"nelements":2,"elements":["Er","Mg"],"chemical_system":"Er-Mg","density":1.8281021013860295,"density_atomic":0.04358649362157733,"volume":3441.433057274951,"volume_molar":13.816529524684599,"formula_full":"Er1 Mg149","formula_reduced":"ErMg149","formula_anonymous":"AB149","formation_energy":0.0003141766277743,"spacegroup":187},{"id":"oqmd-31756","created_at":"2022-09-04T14:49:00.540081Z","updated_at":"2022-09-04T14:49:00.540105Z","structure_string":"Nd1 Mg149\n1.0\n13.826533 -7.982756 0.000000\n0.000000 15.965512 0.000000\n0.000000 0.000000 15.626301\nMg Nd\n149 1\ndirect\n0.599978 0.199957 0.000000 Mg\n0.401339 0.200670 0.000000 Mg\n0.799331 0.200670 0.000000 Mg\n0.003413 0.206073 0.000000 Mg\n0.202660 0.206073 0.000000 Mg\n0.599978 0.400021 0.000000 Mg\n0.800043 0.400021 0.000000 Mg\n0.400159 0.400344 0.000000 Mg\n0.000186 0.400344 0.000000 Mg\n0.201755 0.403509 0.000000 Mg\n0.799331 0.598660 0.000000 Mg\n0.000186 0.599841 0.000000 Mg\n0.599656 0.599841 0.000000 Mg\n0.399718 0.600283 0.000000 Mg\n0.200565 0.600283 0.000000 Mg\n0.003413 0.797340 0.000000 Mg\n0.793927 0.797340 0.000000 Mg\n0.201755 0.798246 0.000000 Mg\n0.596491 0.798246 0.000000 Mg\n0.399718 0.799435 0.000000 Mg\n0.793927 0.996587 0.000000 Mg\n0.202660 0.996587 0.000000 Mg\n0.599656 0.999814 0.000000 Mg\n0.400159 0.999815 0.000000 Mg\n0.262869 0.131435 0.164359 Mg\n0.868566 0.131435 0.164359 Mg\n0.868566 0.737131 0.164359 Mg\n0.666667 0.333333 0.166292 Mg\n0.465333 0.132744 0.166483 Mg\n0.667411 0.132744 0.166483 Mg\n0.867256 0.332589 0.166483 Mg\n0.465333 0.332589 0.166483 Mg\n0.667411 0.534667 0.166483 Mg\n0.867256 0.534667 0.166483 Mg\n0.466693 0.533307 0.167331 Mg\n0.066615 0.533308 0.167331 Mg\n0.466693 0.933385 0.167331 Mg\n0.267201 0.534402 0.167478 Mg\n0.267201 0.732799 0.167478 Mg\n0.465598 0.732799 0.167478 Mg\n0.068008 0.336123 0.167802 Mg\n0.268116 0.336123 0.167802 Mg\n0.068008 0.731884 0.167802 Mg\n0.663877 0.731884 0.167802 Mg\n0.663877 0.931993 0.167802 Mg\n0.268116 0.931993 0.167802 Mg\n0.068205 0.136411 0.170402 Mg\n0.068205 0.931794 0.170402 Mg\n0.863590 0.931795 0.170402 Mg\n0.800070 0.199930 0.332829 Mg\n0.399859 0.199930 0.332829 Mg\n0.800070 0.600141 0.332829 Mg\n0.600085 0.200169 0.332922 Mg\n0.799831 0.399916 0.332922 Mg\n0.600085 0.399916 0.332922 Mg\n0.200682 0.000000 0.333684 Mg\n0.799404 0.000000 0.333684 Mg\n0.000000 0.200595 0.333684 Mg\n0.200682 0.200596 0.333684 Mg\n0.799404 0.799318 0.333684 Mg\n0.000000 0.799318 0.333684 Mg\n0.599721 0.000213 0.333758 Mg\n0.400492 0.000213 0.333758 Mg\n0.400492 0.400279 0.333758 Mg\n0.999787 0.400279 0.333758 Mg\n0.999787 0.599508 0.333758 Mg\n0.599721 0.599508 0.333758 Mg\n0.399958 0.600042 0.333897 Mg\n0.200085 0.600043 0.333897 Mg\n0.399958 0.799915 0.333897 Mg\n0.200321 0.400641 0.334160 Mg\n0.200321 0.799679 0.334160 Mg\n0.599359 0.799680 0.334160 Mg\n0.000000 0.000000 0.334468 Mg\n0.866504 0.133495 0.500000 Mg\n0.266991 0.133496 0.500000 Mg\n0.066790 0.133581 0.500000 Mg\n0.467165 0.134276 0.500000 Mg\n0.667112 0.134277 0.500000 Mg\n0.865723 0.332888 0.500000 Mg\n0.467165 0.332888 0.500000 Mg\n0.666667 0.333333 0.500000 Mg\n0.266916 0.333689 0.500000 Mg\n0.066774 0.333690 0.500000 Mg\n0.865723 0.532835 0.500000 Mg\n0.667112 0.532836 0.500000 Mg\n0.466859 0.533141 0.500000 Mg\n0.066282 0.533141 0.500000 Mg\n0.266764 0.533528 0.500000 Mg\n0.866504 0.733009 0.500000 Mg\n0.666310 0.733084 0.500000 Mg\n0.066774 0.733084 0.500000 Mg\n0.266764 0.733236 0.500000 Mg\n0.466472 0.733236 0.500000 Mg\n0.066790 0.933210 0.500000 Mg\n0.866420 0.933210 0.500000 Mg\n0.666310 0.933226 0.500000 Mg\n0.266916 0.933226 0.500000 Mg\n0.466859 0.933718 0.500000 Mg\n0.000000 0.000000 0.665532 Mg\n0.200321 0.400641 0.665840 Mg\n0.200321 0.799679 0.665840 Mg\n0.599359 0.799680 0.665840 Mg\n0.399958 0.600042 0.666103 Mg\n0.200085 0.600043 0.666103 Mg\n0.399958 0.799915 0.666103 Mg\n0.599721 0.000213 0.666242 Mg\n0.400492 0.000213 0.666242 Mg\n0.400492 0.400279 0.666242 Mg\n0.999787 0.400279 0.666242 Mg\n0.999787 0.599508 0.666242 Mg\n0.599721 0.599508 0.666242 Mg\n0.200682 0.000000 0.666316 Mg\n0.799404 0.000000 0.666316 Mg\n0.000000 0.200595 0.666316 Mg\n0.200682 0.200596 0.666316 Mg\n0.799404 0.799318 0.666316 Mg\n0.000000 0.799318 0.666316 Mg\n0.600085 0.200169 0.667078 Mg\n0.799831 0.399916 0.667078 Mg\n0.600085 0.399916 0.667078 Mg\n0.800070 0.199930 0.667171 Mg\n0.399859 0.199930 0.667171 Mg\n0.800070 0.600141 0.667171 Mg\n0.068205 0.136411 0.829597 Mg\n0.068205 0.931794 0.829597 Mg\n0.863590 0.931795 0.829597 Mg\n0.068008 0.336123 0.832198 Mg\n0.268116 0.336123 0.832198 Mg\n0.068008 0.731884 0.832198 Mg\n0.663877 0.731884 0.832198 Mg\n0.663877 0.931993 0.832198 Mg\n0.268116 0.931993 0.832198 Mg\n0.267201 0.534402 0.832522 Mg\n0.267201 0.732799 0.832522 Mg\n0.465598 0.732799 0.832522 Mg\n0.466693 0.533307 0.832669 Mg\n0.066615 0.533308 0.832669 Mg\n0.466693 0.933385 0.832669 Mg\n0.465333 0.132744 0.833517 Mg\n0.667411 0.132744 0.833517 Mg\n0.867256 0.332589 0.833517 Mg\n0.465333 0.332589 0.833517 Mg\n0.667411 0.534667 0.833517 Mg\n0.867256 0.534667 0.833517 Mg\n0.666667 0.333333 0.833708 Mg\n0.262869 0.131435 0.835641 Mg\n0.868566 0.131435 0.835641 Mg\n0.868566 0.737131 0.835641 Mg\n0.000000 0.000000 0.000000 Nd\n","nsites":150,"nelements":2,"elements":["Mg","Nd"],"chemical_system":"Mg-Nd","density":1.8127628229077652,"density_atomic":0.0434849453279764,"volume":3449.4696697593927,"volume_molar":13.84879459909452,"formula_full":"Nd1 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0.800732 0.000000 Mg\n0.999199 0.802412 0.000000 Mg\n0.803213 0.802412 0.000000 Mg\n0.600428 0.000000 0.000000 Mg\n0.399496 0.000000 0.000000 Mg\n0.065681 0.131362 0.164447 Mg\n0.868639 0.934320 0.164447 Mg\n0.065681 0.934320 0.164447 Mg\n0.265900 0.332240 0.166241 Mg\n0.066341 0.332240 0.166241 Mg\n0.667759 0.734100 0.166241 Mg\n0.066341 0.734100 0.166241 Mg\n0.667759 0.933659 0.166241 Mg\n0.265900 0.933659 0.166241 Mg\n0.666666 0.333333 0.166490 Mg\n0.466657 0.533343 0.166525 Mg\n0.066686 0.533343 0.166525 Mg\n0.466657 0.933315 0.166525 Mg\n0.466640 0.133271 0.166527 Mg\n0.666631 0.133271 0.166527 Mg\n0.466640 0.333370 0.166527 Mg\n0.866729 0.333370 0.166527 Mg\n0.866729 0.533360 0.166527 Mg\n0.666631 0.533360 0.166527 Mg\n0.266450 0.532900 0.166540 Mg\n0.467100 0.733550 0.166540 Mg\n0.266450 0.733550 0.166540 Mg\n0.866429 0.133571 0.167138 Mg\n0.267142 0.133571 0.167138 Mg\n0.866429 0.732858 0.167138 Mg\n0.000000 0.000000 0.332669 Mg\n0.000169 0.199668 0.333000 Mg\n0.199500 0.199669 0.333000 Mg\n0.000169 0.800500 0.333000 Mg\n0.800332 0.800500 0.333000 Mg\n0.199500 0.999832 0.333000 Mg\n0.800332 0.999832 0.333000 Mg\n0.199880 0.399760 0.333098 Mg\n0.199880 0.800120 0.333098 Mg\n0.600241 0.800121 0.333098 Mg\n0.000000 0.399755 0.333137 Mg\n0.399745 0.399755 0.333137 Mg\n0.000000 0.600255 0.333137 Mg\n0.600245 0.600256 0.333137 Mg\n0.600245 0.000000 0.333137 Mg\n0.399745 0.000000 0.333137 Mg\n0.599981 0.199961 0.333181 Mg\n0.800039 0.400019 0.333181 Mg\n0.599981 0.400020 0.333181 Mg\n0.399835 0.199917 0.333318 Mg\n0.800082 0.199918 0.333318 Mg\n0.800082 0.600165 0.333318 Mg\n0.400019 0.599980 0.333321 Mg\n0.199961 0.599981 0.333321 Mg\n0.400019 0.800039 0.333321 Mg\n0.066558 0.133115 0.500000 Mg\n0.266483 0.133242 0.500000 Mg\n0.866758 0.133242 0.500000 Mg\n0.466691 0.133338 0.500000 Mg\n0.666647 0.133338 0.500000 Mg\n0.266529 0.333028 0.500000 Mg\n0.066499 0.333028 0.500000 Mg\n0.666666 0.333333 0.500000 Mg\n0.466691 0.333353 0.500000 Mg\n0.866662 0.333353 0.500000 Mg\n0.266616 0.533233 0.500000 Mg\n0.066569 0.533284 0.500000 Mg\n0.466716 0.533285 0.500000 Mg\n0.866662 0.533309 0.500000 Mg\n0.666647 0.533309 0.500000 Mg\n0.266616 0.733384 0.500000 Mg\n0.466767 0.733384 0.500000 Mg\n0.666972 0.733471 0.500000 Mg\n0.066499 0.733471 0.500000 Mg\n0.866758 0.733517 0.500000 Mg\n0.466716 0.933431 0.500000 Mg\n0.866885 0.933443 0.500000 Mg\n0.066558 0.933443 0.500000 Mg\n0.266529 0.933501 0.500000 Mg\n0.666972 0.933502 0.500000 Mg\n0.400019 0.599980 0.666679 Mg\n0.199961 0.599981 0.666679 Mg\n0.400019 0.800039 0.666679 Mg\n0.399835 0.199917 0.666682 Mg\n0.800082 0.199918 0.666682 Mg\n0.800082 0.600165 0.666682 Mg\n0.599981 0.199961 0.666819 Mg\n0.800039 0.400019 0.666819 Mg\n0.599981 0.400020 0.666819 Mg\n0.000000 0.399755 0.666863 Mg\n0.399745 0.399755 0.666863 Mg\n0.000000 0.600255 0.666863 Mg\n0.600245 0.600256 0.666863 Mg\n0.600245 0.000000 0.666863 Mg\n0.399745 0.000000 0.666863 Mg\n0.199880 0.399760 0.666902 Mg\n0.199880 0.800120 0.666902 Mg\n0.600241 0.800121 0.666902 Mg\n0.000169 0.199668 0.667001 Mg\n0.199500 0.199669 0.667001 Mg\n0.000169 0.800500 0.667001 Mg\n0.800332 0.800500 0.667001 Mg\n0.199500 0.999832 0.667001 Mg\n0.800332 0.999832 0.667001 Mg\n0.000000 0.000000 0.667331 Mg\n0.866429 0.133571 0.832862 Mg\n0.267142 0.133571 0.832862 Mg\n0.866429 0.732858 0.832862 Mg\n0.266450 0.532900 0.833459 Mg\n0.467100 0.733550 0.833459 Mg\n0.266450 0.733550 0.833459 Mg\n0.466640 0.133271 0.833473 Mg\n0.666631 0.133271 0.833473 Mg\n0.466640 0.333370 0.833473 Mg\n0.866729 0.333370 0.833473 Mg\n0.866729 0.533360 0.833473 Mg\n0.666631 0.533360 0.833473 Mg\n0.466657 0.533343 0.833474 Mg\n0.066686 0.533343 0.833474 Mg\n0.466657 0.933315 0.833474 Mg\n0.666666 0.333333 0.833511 Mg\n0.265900 0.332240 0.833759 Mg\n0.066341 0.332240 0.833759 Mg\n0.667759 0.734100 0.833759 Mg\n0.066341 0.734100 0.833759 Mg\n0.667759 0.933659 0.833759 Mg\n0.265900 0.933659 0.833759 Mg\n0.065681 0.131362 0.835553 Mg\n0.868639 0.934320 0.835553 Mg\n0.065681 0.934320 0.835553 Mg\n","nsites":150,"nelements":2,"elements":["Al","Mg"],"chemical_system":"Al-Mg","density":1.77098812794002,"density_atomic":0.043848243955003,"volume":3420.889560684112,"volume_molar":13.734052305902857,"formula_full":"Mg149 Al1","formula_reduced":"Mg149Al","formula_anonymous":"AB149","formation_energy":0.0011436671611079,"spacegroup":187},{"id":"oqmd-31716","created_at":"2022-09-04T14:49:00.286166Z","updated_at":"2022-09-04T14:49:00.286194Z","structure_string":"Mg149 Au1\n1.0\n13.766566 -7.948135 0.000000\n0.000000 15.896269 0.000000\n0.000000 0.000000 15.597970\nAu Mg\n1 149\ndirect\n0.000000 0.000000 0.000000 Au\n0.399047 0.000000 0.000000 Mg\n0.600984 0.000000 0.000000 Mg\n0.195289 0.001525 0.000000 Mg\n0.806237 0.001525 0.000000 Mg\n0.998475 0.193764 0.000000 Mg\n0.195289 0.193764 0.000000 Mg\n0.800703 0.199297 0.000000 Mg\n0.398594 0.199297 0.000000 Mg\n0.599917 0.199835 0.000000 Mg\n0.198723 0.397446 0.000000 Mg\n0.399047 0.399015 0.000000 Mg\n0.000000 0.399016 0.000000 Mg\n0.800165 0.400083 0.000000 Mg\n0.599917 0.400083 0.000000 Mg\n0.199764 0.599882 0.000000 Mg\n0.400118 0.599882 0.000000 Mg\n0.600984 0.600953 0.000000 Mg\n0.000000 0.600954 0.000000 Mg\n0.800703 0.601406 0.000000 Mg\n0.400118 0.800236 0.000000 Mg\n0.602554 0.801277 0.000000 Mg\n0.198723 0.801277 0.000000 Mg\n0.998475 0.804711 0.000000 Mg\n0.806237 0.804711 0.000000 Mg\n0.064802 0.129604 0.161951 Mg\n0.870396 0.935198 0.161951 Mg\n0.064802 0.935198 0.161951 Mg\n0.065999 0.331437 0.165795 Mg\n0.265438 0.331437 0.165795 Mg\n0.065999 0.734562 0.165795 Mg\n0.668563 0.734562 0.165795 Mg\n0.265438 0.934001 0.165795 Mg\n0.668563 0.934001 0.165795 Mg\n0.266310 0.532620 0.166261 Mg\n0.266310 0.733689 0.166261 Mg\n0.467380 0.733690 0.166261 Mg\n0.066680 0.533340 0.166288 Mg\n0.466660 0.533340 0.166288 Mg\n0.466660 0.933319 0.166288 Mg\n0.466949 0.133452 0.166601 Mg\n0.666503 0.133452 0.166601 Mg\n0.466949 0.333497 0.166601 Mg\n0.866549 0.333498 0.166601 Mg\n0.866549 0.533051 0.166601 Mg\n0.666503 0.533051 0.166601 Mg\n0.666667 0.333333 0.166653 Mg\n0.267997 0.133999 0.167383 Mg\n0.866002 0.133999 0.167383 Mg\n0.866002 0.732003 0.167383 Mg\n0.000000 0.000000 0.331623 Mg\n0.199212 0.199484 0.332479 Mg\n0.000272 0.199485 0.332479 Mg\n0.000272 0.800787 0.332479 Mg\n0.800516 0.800788 0.332479 Mg\n0.800516 0.999728 0.332479 Mg\n0.199212 0.999728 0.332479 Mg\n0.399609 0.399720 0.332896 Mg\n0.000112 0.399721 0.332896 Mg\n0.600279 0.600390 0.332896 Mg\n0.000112 0.600391 0.332896 Mg\n0.600279 0.999888 0.332896 Mg\n0.399609 0.999888 0.332896 Mg\n0.199855 0.399711 0.332922 Mg\n0.600289 0.800144 0.332922 Mg\n0.199855 0.800145 0.332922 Mg\n0.200009 0.600004 0.333181 Mg\n0.399995 0.600005 0.333181 Mg\n0.399995 0.799991 0.333181 Mg\n0.599961 0.199921 0.333320 Mg\n0.800079 0.400040 0.333320 Mg\n0.599961 0.400040 0.333320 Mg\n0.399943 0.199971 0.333518 Mg\n0.800028 0.199972 0.333518 Mg\n0.800028 0.600057 0.333518 Mg\n0.066477 0.132954 0.500000 Mg\n0.266336 0.133168 0.500000 Mg\n0.866832 0.133168 0.500000 Mg\n0.466632 0.133225 0.500000 Mg\n0.666593 0.133225 0.500000 Mg\n0.266512 0.332960 0.500000 Mg\n0.066447 0.332960 0.500000 Mg\n0.666667 0.333333 0.500000 Mg\n0.466632 0.333407 0.500000 Mg\n0.866775 0.333408 0.500000 Mg\n0.266554 0.533109 0.500000 Mg\n0.066514 0.533257 0.500000 Mg\n0.466743 0.533257 0.500000 Mg\n0.666593 0.533368 0.500000 Mg\n0.866775 0.533368 0.500000 Mg\n0.466891 0.733445 0.500000 Mg\n0.266554 0.733445 0.500000 Mg\n0.066447 0.733487 0.500000 Mg\n0.667040 0.733487 0.500000 Mg\n0.866832 0.733664 0.500000 Mg\n0.466743 0.933486 0.500000 Mg\n0.867046 0.933523 0.500000 Mg\n0.066477 0.933523 0.500000 Mg\n0.667040 0.933553 0.500000 Mg\n0.266512 0.933553 0.500000 Mg\n0.399943 0.199971 0.666482 Mg\n0.800028 0.199972 0.666482 Mg\n0.800028 0.600057 0.666482 Mg\n0.599961 0.199921 0.666680 Mg\n0.800079 0.400040 0.666680 Mg\n0.599961 0.400040 0.666680 Mg\n0.200009 0.600004 0.666819 Mg\n0.399995 0.600005 0.666819 Mg\n0.399995 0.799991 0.666819 Mg\n0.199855 0.399711 0.667078 Mg\n0.600289 0.800144 0.667078 Mg\n0.199855 0.800145 0.667078 Mg\n0.399609 0.399720 0.667104 Mg\n0.000112 0.399721 0.667104 Mg\n0.600279 0.600390 0.667104 Mg\n0.000112 0.600391 0.667104 Mg\n0.600279 0.999888 0.667104 Mg\n0.399609 0.999888 0.667104 Mg\n0.199212 0.199484 0.667521 Mg\n0.000272 0.199485 0.667521 Mg\n0.000272 0.800787 0.667521 Mg\n0.800516 0.800788 0.667521 Mg\n0.800516 0.999728 0.667521 Mg\n0.199212 0.999728 0.667521 Mg\n0.000000 0.000000 0.668377 Mg\n0.267997 0.133999 0.832617 Mg\n0.866002 0.133999 0.832617 Mg\n0.866002 0.732003 0.832617 Mg\n0.666667 0.333333 0.833347 Mg\n0.466949 0.133452 0.833399 Mg\n0.666503 0.133452 0.833399 Mg\n0.466949 0.333497 0.833399 Mg\n0.866549 0.333498 0.833399 Mg\n0.866549 0.533051 0.833399 Mg\n0.666503 0.533051 0.833399 Mg\n0.066680 0.533340 0.833712 Mg\n0.466660 0.533340 0.833712 Mg\n0.466660 0.933319 0.833712 Mg\n0.266310 0.532620 0.833739 Mg\n0.266310 0.733689 0.833739 Mg\n0.467380 0.733690 0.833739 Mg\n0.065999 0.331437 0.834205 Mg\n0.265438 0.331437 0.834205 Mg\n0.065999 0.734562 0.834205 Mg\n0.668563 0.734562 0.834205 Mg\n0.265438 0.934001 0.834205 Mg\n0.668563 0.934001 0.834205 Mg\n0.064802 0.129604 0.838049 Mg\n0.870396 0.935198 0.838049 Mg\n0.064802 0.935198 0.838049 Mg\n","nsites":150,"nelements":2,"elements":["Au","Mg"],"chemical_system":"Au-Mg","density":1.8575603369250737,"density_atomic":0.04394428005288826,"volume":3413.4135277553873,"volume_molar":13.704037824154074,"formula_full":"Mg149 Au1","formula_reduced":"Mg149Au","formula_anonymous":"AB149","formation_energy":-0.0078426550388921,"spacegroup":187},{"id":"oqmd-31774","created_at":"2022-09-04T14:49:01.171043Z","updated_at":"2022-09-04T14:49:01.171081Z","structure_string":"Mg149 Sb1\n1.0\n13.793912 -7.963922 0.000000\n0.000000 15.927846 0.000000\n0.000000 0.000000 15.631900\nMg Sb\n149 1\ndirect\n0.799370 0.001216 0.000000 Mg\n0.201846 0.001216 0.000000 Mg\n0.799996 0.200004 0.000000 Mg\n0.400008 0.200004 0.000000 Mg\n0.600136 0.200273 0.000000 Mg\n0.998784 0.200630 0.000000 Mg\n0.201846 0.200630 0.000000 Mg\n0.199343 0.398686 0.000000 Mg\n0.600136 0.399863 0.000000 Mg\n0.799727 0.399863 0.000000 Mg\n0.000254 0.400895 0.000000 Mg\n0.400641 0.400896 0.000000 Mg\n0.000254 0.599359 0.000000 Mg\n0.599104 0.599359 0.000000 Mg\n0.799996 0.599993 0.000000 Mg\n0.200021 0.600010 0.000000 Mg\n0.399990 0.600011 0.000000 Mg\n0.998784 0.798154 0.000000 Mg\n0.799370 0.798154 0.000000 Mg\n0.399990 0.799979 0.000000 Mg\n0.601315 0.800657 0.000000 Mg\n0.199343 0.800657 0.000000 Mg\n0.599104 0.999745 0.000000 Mg\n0.400641 0.999746 0.000000 Mg\n0.266301 0.332496 0.166306 Mg\n0.066196 0.332497 0.166306 Mg\n0.667503 0.733699 0.166306 Mg\n0.066196 0.733699 0.166306 Mg\n0.266301 0.933804 0.166306 Mg\n0.667503 0.933804 0.166306 Mg\n0.466693 0.133280 0.166348 Mg\n0.666587 0.133280 0.166348 Mg\n0.866720 0.333413 0.166348 Mg\n0.466693 0.333413 0.166348 Mg\n0.666587 0.533307 0.166348 Mg\n0.866720 0.533307 0.166348 Mg\n0.266431 0.532861 0.166354 Mg\n0.266431 0.733569 0.166354 Mg\n0.467139 0.733569 0.166354 Mg\n0.666667 0.333333 0.166369 Mg\n0.066774 0.533387 0.166594 Mg\n0.466613 0.533387 0.166594 Mg\n0.466613 0.933226 0.166594 Mg\n0.866480 0.133520 0.167290 Mg\n0.267040 0.133520 0.167290 Mg\n0.866480 0.732960 0.167290 Mg\n0.066972 0.133944 0.168070 Mg\n0.866055 0.933027 0.168070 Mg\n0.066972 0.933028 0.168070 Mg\n0.199800 0.399600 0.332887 Mg\n0.600400 0.800200 0.332887 Mg\n0.199800 0.800200 0.332887 Mg\n0.000000 0.000000 0.332899 Mg\n0.399966 0.199983 0.333110 Mg\n0.800017 0.199983 0.333110 Mg\n0.800017 0.600034 0.333110 Mg\n0.600001 0.200001 0.333123 Mg\n0.799999 0.399999 0.333123 Mg\n0.600001 0.400000 0.333123 Mg\n0.399889 0.000000 0.333160 Mg\n0.600129 0.000000 0.333160 Mg\n0.000000 0.399871 0.333160 Mg\n0.399889 0.399871 0.333160 Mg\n0.000000 0.600111 0.333160 Mg\n0.600129 0.600111 0.333160 Mg\n0.399997 0.600002 0.333221 Mg\n0.200005 0.600002 0.333221 Mg\n0.399997 0.799995 0.333221 Mg\n0.800096 0.000000 0.333820 Mg\n0.199980 0.000000 0.333820 Mg\n0.199980 0.199905 0.333820 Mg\n0.000000 0.199905 0.333820 Mg\n0.000000 0.800021 0.333820 Mg\n0.800096 0.800021 0.333820 Mg\n0.066588 0.133176 0.500000 Mg\n0.666545 0.133333 0.500000 Mg\n0.466789 0.133334 0.500000 Mg\n0.266726 0.133363 0.500000 Mg\n0.866637 0.133363 0.500000 Mg\n0.266594 0.333262 0.500000 Mg\n0.066669 0.333263 0.500000 Mg\n0.666667 0.333333 0.500000 Mg\n0.466789 0.333455 0.500000 Mg\n0.866666 0.333455 0.500000 Mg\n0.666545 0.533211 0.500000 Mg\n0.866666 0.533212 0.500000 Mg\n0.266697 0.533394 0.500000 Mg\n0.066823 0.533411 0.500000 Mg\n0.466588 0.533411 0.500000 Mg\n0.866637 0.733274 0.500000 Mg\n0.466606 0.733303 0.500000 Mg\n0.266697 0.733303 0.500000 Mg\n0.666738 0.733407 0.500000 Mg\n0.066669 0.733407 0.500000 Mg\n0.466588 0.933177 0.500000 Mg\n0.266594 0.933331 0.500000 Mg\n0.666738 0.933331 0.500000 Mg\n0.866824 0.933412 0.500000 Mg\n0.066588 0.933412 0.500000 Mg\n0.800096 0.000000 0.666180 Mg\n0.199980 0.000000 0.666180 Mg\n0.199980 0.199905 0.666180 Mg\n0.000000 0.199905 0.666180 Mg\n0.000000 0.800021 0.666180 Mg\n0.800096 0.800021 0.666180 Mg\n0.399997 0.600002 0.666779 Mg\n0.200005 0.600002 0.666779 Mg\n0.399997 0.799995 0.666779 Mg\n0.399889 0.000000 0.666840 Mg\n0.600129 0.000000 0.666840 Mg\n0.000000 0.399871 0.666840 Mg\n0.399889 0.399871 0.666840 Mg\n0.000000 0.600111 0.666840 Mg\n0.600129 0.600111 0.666840 Mg\n0.600001 0.200001 0.666876 Mg\n0.799999 0.399999 0.666876 Mg\n0.600001 0.400000 0.666876 Mg\n0.399966 0.199983 0.666890 Mg\n0.800017 0.199983 0.666890 Mg\n0.800017 0.600034 0.666890 Mg\n0.000000 0.000000 0.667101 Mg\n0.199800 0.399600 0.667113 Mg\n0.600400 0.800200 0.667113 Mg\n0.199800 0.800200 0.667113 Mg\n0.066972 0.133944 0.831930 Mg\n0.866055 0.933027 0.831930 Mg\n0.066972 0.933028 0.831930 Mg\n0.866480 0.133520 0.832710 Mg\n0.267040 0.133520 0.832710 Mg\n0.866480 0.732960 0.832710 Mg\n0.066774 0.533387 0.833406 Mg\n0.466613 0.533387 0.833406 Mg\n0.466613 0.933226 0.833406 Mg\n0.666667 0.333333 0.833631 Mg\n0.266431 0.532861 0.833646 Mg\n0.266431 0.733569 0.833646 Mg\n0.467139 0.733569 0.833646 Mg\n0.466693 0.133280 0.833652 Mg\n0.666587 0.133280 0.833652 Mg\n0.866720 0.333413 0.833652 Mg\n0.466693 0.333413 0.833652 Mg\n0.666587 0.533307 0.833652 Mg\n0.866720 0.533307 0.833652 Mg\n0.266301 0.332496 0.833694 Mg\n0.066196 0.332497 0.833694 Mg\n0.667503 0.733699 0.833694 Mg\n0.066196 0.733699 0.833694 Mg\n0.266301 0.933804 0.833694 Mg\n0.667503 0.933804 0.833694 Mg\n0.000000 0.000000 0.000000 Sb\n","nsites":150,"nelements":2,"elements":["Mg","Sb"],"chemical_system":"Mg-Sb","density":1.8098244146985876,"density_atomic":0.04367520899856931,"volume":3434.442637811158,"volume_molar":13.78846466469633,"formula_full":"Mg149 Sb1","formula_reduced":"Mg149Sb","formula_anonymous":"AB149","formation_energy":-0.0025410637388921,"spacegroup":187},{"id":"oqmd-31717","created_at":"2022-09-04T14:49:01.155542Z","updated_at":"2022-09-04T14:49:01.155576Z","structure_string":"Mg149 B1\n1.0\n13.757037 -7.942633 0.000000\n0.000000 15.885265 0.000000\n0.000000 0.000000 15.584184\nB Mg\n1 149\ndirect\n0.000000 0.000000 0.000000 B\n0.192582 0.001649 0.000000 Mg\n0.809067 0.001649 0.000000 Mg\n0.192582 0.190934 0.000000 Mg\n0.998352 0.190934 0.000000 Mg\n0.397887 0.198943 0.000000 Mg\n0.801057 0.198944 0.000000 Mg\n0.599886 0.199771 0.000000 Mg\n0.198189 0.396379 0.000000 Mg\n0.398690 0.398701 0.000000 Mg\n0.000000 0.398701 0.000000 Mg\n0.800229 0.400115 0.000000 Mg\n0.599886 0.400115 0.000000 Mg\n0.400178 0.599821 0.000000 Mg\n0.199643 0.599821 0.000000 Mg\n0.000000 0.601310 0.000000 Mg\n0.601300 0.601311 0.000000 Mg\n0.801057 0.602113 0.000000 Mg\n0.400178 0.800357 0.000000 Mg\n0.198189 0.801810 0.000000 Mg\n0.603621 0.801810 0.000000 Mg\n0.809067 0.807418 0.000000 Mg\n0.998352 0.807419 0.000000 Mg\n0.398690 0.000000 0.000000 Mg\n0.601300 0.000000 0.000000 Mg\n0.063791 0.127581 0.159516 Mg\n0.872419 0.936209 0.159516 Mg\n0.063791 0.936209 0.159516 Mg\n0.065751 0.330635 0.165483 Mg\n0.264883 0.330635 0.165483 Mg\n0.065751 0.735117 0.165483 Mg\n0.669366 0.735117 0.165483 Mg\n0.669366 0.934249 0.165483 Mg\n0.264883 0.934249 0.165483 Mg\n0.266145 0.532289 0.165931 Mg\n0.266145 0.733855 0.165931 Mg\n0.467710 0.733855 0.165931 Mg\n0.066490 0.533245 0.166068 Mg\n0.466755 0.533245 0.166068 Mg\n0.466755 0.933509 0.166068 Mg\n0.466635 0.133366 0.166419 Mg\n0.666731 0.133366 0.166419 Mg\n0.866634 0.333269 0.166419 Mg\n0.466635 0.333269 0.166419 Mg\n0.866634 0.533364 0.166419 Mg\n0.666731 0.533365 0.166419 Mg\n0.666667 0.333333 0.166423 Mg\n0.866381 0.133619 0.167051 Mg\n0.267238 0.133619 0.167051 Mg\n0.866381 0.732763 0.167051 Mg\n0.000000 0.000000 0.330591 Mg\n0.000375 0.199135 0.332264 Mg\n0.198761 0.199136 0.332264 Mg\n0.000375 0.801239 0.332264 Mg\n0.800864 0.801239 0.332264 Mg\n0.800864 0.999625 0.332264 Mg\n0.198761 0.999625 0.332264 Mg\n0.199731 0.399462 0.332621 Mg\n0.199731 0.800269 0.332621 Mg\n0.600538 0.800269 0.332621 Mg\n0.000196 0.399584 0.332746 Mg\n0.399388 0.399584 0.332746 Mg\n0.000196 0.600612 0.332746 Mg\n0.600416 0.600612 0.332746 Mg\n0.600416 0.999803 0.332746 Mg\n0.399388 0.999804 0.332746 Mg\n0.399999 0.600000 0.332962 Mg\n0.200002 0.600001 0.332962 Mg\n0.399999 0.799998 0.332962 Mg\n0.599909 0.199818 0.333133 Mg\n0.599909 0.400091 0.333133 Mg\n0.800182 0.400091 0.333133 Mg\n0.800260 0.199739 0.333282 Mg\n0.399479 0.199740 0.333282 Mg\n0.800260 0.600521 0.333282 Mg\n0.066336 0.132672 0.500000 Mg\n0.266174 0.133087 0.500000 Mg\n0.866913 0.133087 0.500000 Mg\n0.666628 0.133245 0.500000 Mg\n0.466617 0.133245 0.500000 Mg\n0.266230 0.332579 0.500000 Mg\n0.066349 0.332579 0.500000 Mg\n0.666667 0.333333 0.500000 Mg\n0.866755 0.333372 0.500000 Mg\n0.466617 0.333372 0.500000 Mg\n0.266520 0.533041 0.500000 Mg\n0.066571 0.533285 0.500000 Mg\n0.466715 0.533286 0.500000 Mg\n0.666628 0.533383 0.500000 Mg\n0.866755 0.533383 0.500000 Mg\n0.466959 0.733479 0.500000 Mg\n0.266520 0.733479 0.500000 Mg\n0.066349 0.733770 0.500000 Mg\n0.667421 0.733770 0.500000 Mg\n0.866913 0.733825 0.500000 Mg\n0.466715 0.933429 0.500000 Mg\n0.667421 0.933652 0.500000 Mg\n0.266230 0.933652 0.500000 Mg\n0.066336 0.933664 0.500000 Mg\n0.867328 0.933664 0.500000 Mg\n0.800260 0.199739 0.666718 Mg\n0.399479 0.199740 0.666718 Mg\n0.800260 0.600521 0.666718 Mg\n0.599909 0.199818 0.666867 Mg\n0.599909 0.400091 0.666867 Mg\n0.800182 0.400091 0.666867 Mg\n0.399999 0.600000 0.667038 Mg\n0.200002 0.600001 0.667038 Mg\n0.399999 0.799998 0.667038 Mg\n0.000196 0.399584 0.667254 Mg\n0.399388 0.399584 0.667254 Mg\n0.000196 0.600612 0.667254 Mg\n0.600416 0.600612 0.667254 Mg\n0.600416 0.999803 0.667254 Mg\n0.399388 0.999804 0.667254 Mg\n0.199731 0.399462 0.667379 Mg\n0.199731 0.800269 0.667379 Mg\n0.600538 0.800269 0.667379 Mg\n0.000375 0.199135 0.667736 Mg\n0.198761 0.199136 0.667736 Mg\n0.000375 0.801239 0.667736 Mg\n0.800864 0.801239 0.667736 Mg\n0.800864 0.999625 0.667736 Mg\n0.198761 0.999625 0.667736 Mg\n0.000000 0.000000 0.669409 Mg\n0.866381 0.133619 0.832949 Mg\n0.267238 0.133619 0.832949 Mg\n0.866381 0.732763 0.832949 Mg\n0.666667 0.333333 0.833577 Mg\n0.466635 0.133366 0.833581 Mg\n0.666731 0.133366 0.833581 Mg\n0.866634 0.333269 0.833581 Mg\n0.466635 0.333269 0.833581 Mg\n0.866634 0.533364 0.833581 Mg\n0.666731 0.533365 0.833581 Mg\n0.066490 0.533245 0.833931 Mg\n0.466755 0.533245 0.833931 Mg\n0.466755 0.933509 0.833931 Mg\n0.266145 0.532289 0.834069 Mg\n0.266145 0.733855 0.834069 Mg\n0.467710 0.733855 0.834069 Mg\n0.065751 0.330635 0.834518 Mg\n0.264883 0.330635 0.834518 Mg\n0.065751 0.735117 0.834518 Mg\n0.669366 0.735117 0.834518 Mg\n0.669366 0.934249 0.834518 Mg\n0.264883 0.934249 0.834518 Mg\n0.063791 0.127581 0.840484 Mg\n0.872419 0.936209 0.840484 Mg\n0.063791 0.936209 0.840484 Mg\n","nsites":150,"nelements":2,"elements":["B","Mg"],"chemical_system":"B-Mg","density":1.7710144740378013,"density_atomic":0.04404410834893812,"volume":3405.6768458480196,"volume_molar":13.67297689917973,"formula_full":"Mg149 B1","formula_reduced":"Mg149B","formula_anonymous":"AB149","formation_energy":0.0195602923611078,"spacegroup":187},{"id":"oqmd-31734","created_at":"2022-09-04T14:49:01.470734Z","updated_at":"2022-09-04T14:49:01.470770Z","structure_string":"Mg149 F1\n1.0\n13.779410 -7.955550 0.000000\n0.000000 15.911100 0.000000\n0.000000 0.000000 15.573453\nF Mg\n1 149\ndirect\n0.000000 0.000000 0.000000 F\n0.803307 0.000822 0.000000 Mg\n0.197516 0.000823 0.000000 Mg\n0.197516 0.196694 0.000000 Mg\n0.999178 0.196694 0.000000 Mg\n0.399313 0.199657 0.000000 Mg\n0.800343 0.199657 0.000000 Mg\n0.600069 0.200138 0.000000 Mg\n0.199168 0.398336 0.000000 Mg\n0.799862 0.399931 0.000000 Mg\n0.600069 0.399931 0.000000 Mg\n0.000327 0.399979 0.000000 Mg\n0.399652 0.399979 0.000000 Mg\n0.399796 0.600204 0.000000 Mg\n0.200408 0.600204 0.000000 Mg\n0.600021 0.600348 0.000000 Mg\n0.000327 0.600348 0.000000 Mg\n0.800343 0.600686 0.000000 Mg\n0.399796 0.799592 0.000000 Mg\n0.601664 0.800832 0.000000 Mg\n0.199168 0.800832 0.000000 Mg\n0.999178 0.802484 0.000000 Mg\n0.803307 0.802484 0.000000 Mg\n0.399652 0.999673 0.000000 Mg\n0.600021 0.999673 0.000000 Mg\n0.065387 0.130774 0.163546 Mg\n0.065387 0.934613 0.163546 Mg\n0.869226 0.934613 0.163546 Mg\n0.266453 0.532905 0.166108 Mg\n0.467095 0.733547 0.166108 Mg\n0.266453 0.733547 0.166108 Mg\n0.265930 0.332231 0.166145 Mg\n0.066301 0.332231 0.166145 Mg\n0.667769 0.734070 0.166145 Mg\n0.066301 0.734070 0.166145 Mg\n0.667769 0.933699 0.166145 Mg\n0.265930 0.933699 0.166145 Mg\n0.666666 0.333333 0.166217 Mg\n0.666931 0.133142 0.166349 Mg\n0.466211 0.133142 0.166349 Mg\n0.866858 0.333068 0.166349 Mg\n0.466211 0.333068 0.166349 Mg\n0.666931 0.533789 0.166349 Mg\n0.866858 0.533790 0.166349 Mg\n0.265579 0.132789 0.166418 Mg\n0.867211 0.132790 0.166418 Mg\n0.867211 0.734421 0.166418 Mg\n0.466718 0.533282 0.166613 Mg\n0.066564 0.533282 0.166613 Mg\n0.466718 0.933436 0.166613 Mg\n0.000000 0.000000 0.330374 Mg\n0.199909 0.399818 0.332946 Mg\n0.199909 0.800090 0.332946 Mg\n0.600182 0.800091 0.332946 Mg\n0.599948 0.199897 0.332963 Mg\n0.599948 0.400051 0.332963 Mg\n0.800103 0.400052 0.332963 Mg\n0.399503 0.199752 0.333030 Mg\n0.800248 0.199752 0.333030 Mg\n0.800248 0.600496 0.333030 Mg\n0.399827 0.399951 0.333040 Mg\n0.000124 0.399951 0.333040 Mg\n0.600048 0.600172 0.333040 Mg\n0.000124 0.600173 0.333040 Mg\n0.600048 0.999876 0.333040 Mg\n0.399827 0.999876 0.333040 Mg\n0.199523 0.199821 0.333044 Mg\n0.000298 0.199821 0.333044 Mg\n0.000298 0.800477 0.333044 Mg\n0.800179 0.800477 0.333044 Mg\n0.199523 0.999702 0.333044 Mg\n0.800179 0.999703 0.333044 Mg\n0.200017 0.600009 0.333120 Mg\n0.399991 0.600009 0.333120 Mg\n0.399991 0.799982 0.333120 Mg\n0.066367 0.132735 0.500000 Mg\n0.266608 0.133304 0.500000 Mg\n0.866696 0.133304 0.500000 Mg\n0.666844 0.133606 0.500000 Mg\n0.466762 0.133606 0.500000 Mg\n0.266399 0.332961 0.500000 Mg\n0.066562 0.332961 0.500000 Mg\n0.866393 0.333156 0.500000 Mg\n0.466762 0.333156 0.500000 Mg\n0.666666 0.333333 0.500000 Mg\n0.266617 0.533233 0.500000 Mg\n0.866393 0.533238 0.500000 Mg\n0.666844 0.533238 0.500000 Mg\n0.066583 0.533291 0.500000 Mg\n0.466709 0.533291 0.500000 Mg\n0.466767 0.733383 0.500000 Mg\n0.266617 0.733384 0.500000 Mg\n0.866696 0.733392 0.500000 Mg\n0.667039 0.733601 0.500000 Mg\n0.066562 0.733601 0.500000 Mg\n0.466709 0.933417 0.500000 Mg\n0.667039 0.933438 0.500000 Mg\n0.266399 0.933438 0.500000 Mg\n0.066367 0.933632 0.500000 Mg\n0.867265 0.933632 0.500000 Mg\n0.200017 0.600009 0.666880 Mg\n0.399991 0.600009 0.666880 Mg\n0.399991 0.799982 0.666880 Mg\n0.199523 0.199821 0.666956 Mg\n0.000298 0.199821 0.666956 Mg\n0.000298 0.800477 0.666956 Mg\n0.800179 0.800477 0.666956 Mg\n0.199523 0.999702 0.666956 Mg\n0.800179 0.999703 0.666956 Mg\n0.399827 0.399951 0.666959 Mg\n0.000124 0.399951 0.666959 Mg\n0.600048 0.600172 0.666959 Mg\n0.000124 0.600173 0.666959 Mg\n0.600048 0.999876 0.666959 Mg\n0.399827 0.999876 0.666959 Mg\n0.399503 0.199752 0.666970 Mg\n0.800248 0.199752 0.666970 Mg\n0.800248 0.600496 0.666970 Mg\n0.599948 0.199897 0.667036 Mg\n0.599948 0.400051 0.667036 Mg\n0.800103 0.400052 0.667036 Mg\n0.199909 0.399818 0.667054 Mg\n0.199909 0.800090 0.667054 Mg\n0.600182 0.800091 0.667054 Mg\n0.000000 0.000000 0.669625 Mg\n0.466718 0.533282 0.833387 Mg\n0.066564 0.533282 0.833387 Mg\n0.466718 0.933436 0.833387 Mg\n0.265579 0.132789 0.833582 Mg\n0.867211 0.132790 0.833582 Mg\n0.867211 0.734421 0.833582 Mg\n0.666931 0.133142 0.833651 Mg\n0.466211 0.133142 0.833651 Mg\n0.866858 0.333068 0.833651 Mg\n0.466211 0.333068 0.833651 Mg\n0.666931 0.533789 0.833651 Mg\n0.866858 0.533790 0.833651 Mg\n0.666666 0.333333 0.833783 Mg\n0.265930 0.332231 0.833856 Mg\n0.066301 0.332231 0.833856 Mg\n0.667769 0.734070 0.833856 Mg\n0.066301 0.734070 0.833856 Mg\n0.667769 0.933699 0.833856 Mg\n0.265930 0.933699 0.833856 Mg\n0.266453 0.532905 0.833892 Mg\n0.467095 0.733547 0.833892 Mg\n0.266453 0.733547 0.833892 Mg\n0.065387 0.130774 0.836454 Mg\n0.065387 0.934613 0.836454 Mg\n0.869226 0.934613 0.836454 Mg\n","nsites":150,"nelements":2,"elements":["F","Mg"],"chemical_system":"F-Mg","density":1.7704661864609872,"density_atomic":0.04393144766376941,"volume":3414.4105868768374,"volume_molar":13.708040777737683,"formula_full":"Mg149 F1","formula_reduced":"Mg149F","formula_anonymous":"AB149","formation_energy":-0.0166814289664328,"spacegroup":187},{"id":"oqmd-31785","created_at":"2022-09-04T14:49:01.357428Z","updated_at":"2022-09-04T14:49:01.357455Z","structure_string":"Th1 Mg149\n1.0\n13.825206 -7.981990 0.000000\n0.000000 15.963979 0.000000\n0.000000 0.000000 15.625149\nMg Th\n149 1\ndirect\n0.599920 0.199840 0.000000 Mg\n0.799245 0.200754 0.000000 Mg\n0.401509 0.200754 0.000000 Mg\n0.202952 0.206744 0.000000 Mg\n0.003792 0.206744 0.000000 Mg\n0.800160 0.400080 0.000000 Mg\n0.599920 0.400080 0.000000 Mg\n0.400220 0.400407 0.000000 Mg\n0.000187 0.400408 0.000000 Mg\n0.201850 0.403700 0.000000 Mg\n0.799245 0.598491 0.000000 Mg\n0.599592 0.599779 0.000000 Mg\n0.000187 0.599779 0.000000 Mg\n0.200487 0.600243 0.000000 Mg\n0.399757 0.600244 0.000000 Mg\n0.003792 0.797048 0.000000 Mg\n0.793256 0.797048 0.000000 Mg\n0.596299 0.798150 0.000000 Mg\n0.201850 0.798150 0.000000 Mg\n0.399757 0.799513 0.000000 Mg\n0.202952 0.996208 0.000000 Mg\n0.793256 0.996208 0.000000 Mg\n0.400220 0.999812 0.000000 Mg\n0.599592 0.999812 0.000000 Mg\n0.868802 0.131197 0.163958 Mg\n0.262395 0.131197 0.163958 Mg\n0.868802 0.737605 0.163958 Mg\n0.666666 0.333333 0.166348 Mg\n0.465299 0.132749 0.166454 Mg\n0.667450 0.132749 0.166454 Mg\n0.867251 0.332550 0.166454 Mg\n0.465299 0.332550 0.166454 Mg\n0.667450 0.534701 0.166454 Mg\n0.867251 0.534701 0.166454 Mg\n0.466674 0.533326 0.167232 Mg\n0.066651 0.533326 0.167232 Mg\n0.466674 0.933349 0.167232 Mg\n0.267244 0.534489 0.167499 Mg\n0.465511 0.732755 0.167499 Mg\n0.267244 0.732755 0.167499 Mg\n0.268260 0.336295 0.167845 Mg\n0.068034 0.336295 0.167845 Mg\n0.663705 0.731740 0.167845 Mg\n0.068034 0.731740 0.167845 Mg\n0.268260 0.931965 0.167845 Mg\n0.663705 0.931965 0.167845 Mg\n0.068472 0.136944 0.170681 Mg\n0.863055 0.931528 0.170681 Mg\n0.068472 0.931528 0.170681 Mg\n0.800119 0.199881 0.332773 Mg\n0.399762 0.199881 0.332773 Mg\n0.800119 0.600238 0.332773 Mg\n0.600096 0.200193 0.332913 Mg\n0.600096 0.399903 0.332913 Mg\n0.799807 0.399904 0.332913 Mg\n0.200722 0.000170 0.333612 Mg\n0.799448 0.000170 0.333612 Mg\n0.200722 0.200551 0.333612 Mg\n0.999830 0.200551 0.333612 Mg\n0.999830 0.799278 0.333612 Mg\n0.799448 0.799278 0.333612 Mg\n0.599768 0.000223 0.333745 Mg\n0.400455 0.000223 0.333745 Mg\n0.400455 0.400231 0.333745 Mg\n0.999777 0.400232 0.333745 Mg\n0.599768 0.599545 0.333745 Mg\n0.999777 0.599545 0.333745 Mg\n0.200093 0.600047 0.333981 Mg\n0.399954 0.600047 0.333981 Mg\n0.399954 0.799907 0.333981 Mg\n0.200296 0.400593 0.334212 Mg\n0.200296 0.799703 0.334212 Mg\n0.599407 0.799703 0.334212 Mg\n0.000000 0.000000 0.334563 Mg\n0.266886 0.133443 0.500000 Mg\n0.866557 0.133443 0.500000 Mg\n0.066804 0.133608 0.500000 Mg\n0.667176 0.134365 0.500000 Mg\n0.467189 0.134366 0.500000 Mg\n0.865634 0.332823 0.500000 Mg\n0.467189 0.332824 0.500000 Mg\n0.666666 0.333333 0.500000 Mg\n0.266899 0.333585 0.500000 Mg\n0.066685 0.333585 0.500000 Mg\n0.865634 0.532810 0.500000 Mg\n0.667176 0.532811 0.500000 Mg\n0.466907 0.533093 0.500000 Mg\n0.066186 0.533093 0.500000 Mg\n0.266717 0.533434 0.500000 Mg\n0.666415 0.733100 0.500000 Mg\n0.066685 0.733101 0.500000 Mg\n0.866557 0.733114 0.500000 Mg\n0.266717 0.733283 0.500000 Mg\n0.466566 0.733283 0.500000 Mg\n0.866392 0.933196 0.500000 Mg\n0.066804 0.933197 0.500000 Mg\n0.266899 0.933315 0.500000 Mg\n0.666415 0.933315 0.500000 Mg\n0.466907 0.933814 0.500000 Mg\n0.000000 0.000000 0.665437 Mg\n0.200296 0.400593 0.665788 Mg\n0.200296 0.799703 0.665788 Mg\n0.599407 0.799703 0.665788 Mg\n0.200093 0.600047 0.666019 Mg\n0.399954 0.600047 0.666019 Mg\n0.399954 0.799907 0.666019 Mg\n0.599768 0.000223 0.666255 Mg\n0.400455 0.000223 0.666255 Mg\n0.400455 0.400231 0.666255 Mg\n0.999777 0.400232 0.666255 Mg\n0.599768 0.599545 0.666255 Mg\n0.999777 0.599545 0.666255 Mg\n0.200722 0.000170 0.666388 Mg\n0.799448 0.000170 0.666388 Mg\n0.200722 0.200551 0.666388 Mg\n0.999830 0.200551 0.666388 Mg\n0.999830 0.799278 0.666388 Mg\n0.799448 0.799278 0.666388 Mg\n0.600096 0.200193 0.667087 Mg\n0.600096 0.399903 0.667087 Mg\n0.799807 0.399904 0.667087 Mg\n0.800119 0.199881 0.667228 Mg\n0.399762 0.199881 0.667228 Mg\n0.800119 0.600238 0.667228 Mg\n0.068472 0.136944 0.829319 Mg\n0.863055 0.931528 0.829319 Mg\n0.068472 0.931528 0.829319 Mg\n0.268260 0.336295 0.832155 Mg\n0.068034 0.336295 0.832155 Mg\n0.663705 0.731740 0.832155 Mg\n0.068034 0.731740 0.832155 Mg\n0.268260 0.931965 0.832155 Mg\n0.663705 0.931965 0.832155 Mg\n0.267244 0.534489 0.832501 Mg\n0.465511 0.732755 0.832501 Mg\n0.267244 0.732755 0.832501 Mg\n0.466674 0.533326 0.832768 Mg\n0.066651 0.533326 0.832768 Mg\n0.466674 0.933349 0.832768 Mg\n0.465299 0.132749 0.833545 Mg\n0.667450 0.132749 0.833545 Mg\n0.867251 0.332550 0.833545 Mg\n0.465299 0.332550 0.833545 Mg\n0.667450 0.534701 0.833545 Mg\n0.867251 0.534701 0.833545 Mg\n0.666666 0.333333 0.833652 Mg\n0.868802 0.131197 0.836042 Mg\n0.262395 0.131197 0.836042 Mg\n0.868802 0.737605 0.836042 Mg\n0.000000 0.000000 0.000000 Th\n","nsites":150,"nelements":2,"elements":["Mg","Th"],"chemical_system":"Mg-Th","density":1.8555199376612532,"density_atomic":0.04349650203773333,"volume":3448.553170318721,"volume_molar":13.845115073335728,"formula_full":"Th1 Mg149","formula_reduced":"ThMg149","formula_anonymous":"AB149","formation_energy":0.0049962298277745,"spacegroup":187}]}