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{
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"results": [
{
"id": "mp-1195995",
"created_at": "2022-09-04T14:41:56.498614Z",
"structure_string": "Co4 H48 C8 Br16 N8\n1.0\n8.204433 0.000000 0.000000\n0.000000 13.409305 0.000000\n-1.286944 0.000000 11.527408\nCo H C Br N\n4 48 8 16 8\ndirect\n0.732415 0.937755 0.271565 Co\n0.267585 0.437755 0.228435 Co\n0.267585 0.062245 0.728435 Co\n0.732415 0.562245 0.771565 Co\n0.279576 0.723718 0.039101 H\n0.720424 0.223718 0.460899 H\n0.720424 0.276282 0.960899 H\n0.279576 0.776282 0.539101 H\n0.284313 0.800476 0.923671 H\n0.715687 0.300476 0.576329 H\n0.715687 0.199524 0.076329 H\n0.284313 0.699524 0.423671 H\n0.418258 0.816146 0.042184 H\n0.581742 0.316146 0.457816 H\n0.581742 0.183854 0.957816 H\n0.418258 0.683854 0.542184 H\n0.800978 0.837154 0.583375 H\n0.199022 0.337154 0.916625 H\n0.199022 0.162846 0.416625 H\n0.800978 0.662846 0.083375 H\n0.674364 0.933781 0.582706 H\n0.325636 0.433781 0.917294 H\n0.325636 0.066219 0.417294 H\n0.674364 0.566219 0.082706 H\n0.874651 0.951389 0.619557 H\n0.125349 0.451389 0.880443 H\n0.125349 0.048611 0.380443 H\n0.874651 0.548611 0.119557 H\n0.806000 0.358771 0.343364 H\n0.194000 0.858771 0.156636 H\n0.194000 0.641229 0.656636 H\n0.806000 0.141229 0.843364 H\n0.797782 0.440278 0.466384 H\n0.202218 0.940278 0.033616 H\n0.202218 0.559722 0.533616 H\n0.797782 0.059722 0.966384 H\n0.946470 0.341936 0.471245 H\n0.053530 0.841936 0.028755 H\n0.053530 0.658064 0.528755 H\n0.946470 0.158064 0.971245 H\n0.861705 0.838606 0.789105 H\n0.138295 0.338606 0.710895 H\n0.138295 0.161394 0.210895 H\n0.861705 0.661394 0.289105 H\n0.748897 0.953149 0.794726 H\n0.251103 0.453149 0.705274 H\n0.251103 0.046851 0.205274 H\n0.748897 0.546851 0.294726 H\n0.643079 0.839861 0.754171 H\n0.356921 0.339861 0.745829 H\n0.356921 0.160139 0.245829 H\n0.643079 0.660139 0.254171 H\n0.821834 0.364362 0.438078 C\n0.178166 0.864362 0.061922 C\n0.178166 0.635638 0.561922 C\n0.821834 0.135638 0.938078 C\n0.756620 0.881841 0.750375 C\n0.243380 0.381841 0.749625 C\n0.243380 0.118159 0.249625 C\n0.756620 0.618159 0.250375 C\n0.985758 0.880258 0.374080 Br\n0.014242 0.380258 0.125920 Br\n0.014242 0.119742 0.625920 Br\n0.985758 0.619742 0.874080 Br\n0.692463 0.865437 0.079693 Br\n0.307537 0.365437 0.420307 Br\n0.307537 0.134563 0.920307 Br\n0.692463 0.634563 0.579693 Br\n0.755231 0.117294 0.266663 Br\n0.244769 0.617294 0.233337 Br\n0.244769 0.882706 0.733337 Br\n0.755231 0.382706 0.766663 Br\n0.504035 0.892042 0.372295 Br\n0.495965 0.392042 0.127705 Br\n0.495965 0.107958 0.627705 Br\n0.504035 0.607958 0.872295 Br\n0.296993 0.796343 0.013907 N\n0.703007 0.296343 0.486093 N\n0.703007 0.203657 0.986093 N\n0.296993 0.703657 0.513907 N\n0.778411 0.902026 0.626712 N\n0.221589 0.402026 0.873288 N\n0.221589 0.097974 0.373288 N\n0.778411 0.597974 0.126712 N\n",
"nsites": 84,
"nelements": 5,
"elements": [
"Co",
"H",
"C",
"Br",
"N"
],
"chemical_system": "Br-C-Co-H-N",
"density": 2.3185249412235853,
"density_atomic": 0.06623579897327025,
"volume": 1268.1963726881074,
"volume_molar": 9.091972699582383,
"formula_full": "Co4 H48 C8 Br16 N8",
"formula_reduced": "CoH12C2(Br2N)2",
"formula_anonymous": "AB2C2D4E12",
"energy": -401.88224915,
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"updated_at": "2021-11-28T01:35:34.329000Z",
"spacegroup": 14
},
{
"id": "mp-705011",
"created_at": "2022-09-04T14:41:56.513398Z",
"structure_string": "Li4 Fe4 P8 O28\n1.0\n6.698898 4.095809 0.000000\n-6.698898 4.095809 0.000000\n0.000000 0.465372 10.638234\nLi Fe P O\n4 4 8 28\ndirect\n0.715714 0.280898 0.000175 Li\n0.719102 0.284286 0.499825 Li\n0.284286 0.719102 0.999825 Li\n0.280898 0.715714 0.500175 Li\n0.688044 0.688600 0.891226 Fe\n0.311956 0.311400 0.108774 Fe\n0.688600 0.688044 0.391226 Fe\n0.311400 0.311956 0.608774 Fe\n0.296930 0.089116 0.865623 P\n0.099195 0.319558 0.864488 P\n0.910884 0.703070 0.634377 P\n0.703070 0.910884 0.134377 P\n0.680442 0.900805 0.635512 P\n0.900805 0.680442 0.135512 P\n0.319558 0.099195 0.364488 P\n0.089116 0.296930 0.365623 P\n0.096693 0.108622 0.879351 O\n0.099753 0.707843 0.122915 O\n0.900247 0.292157 0.877085 O\n0.707843 0.099753 0.622915 O\n0.108622 0.096693 0.379351 O\n0.200474 0.403172 0.734767 O\n0.812545 0.614165 0.763971 O\n0.403172 0.200474 0.234767 O\n0.903307 0.891378 0.120649 O\n0.563570 0.764800 0.528700 O\n0.385835 0.187455 0.736029 O\n0.799526 0.596828 0.265233 O\n0.420771 0.215722 0.973465 O\n0.596828 0.799526 0.765233 O\n0.614165 0.812545 0.263971 O\n0.215722 0.420771 0.473465 O\n0.784278 0.579229 0.526535 O\n0.764800 0.563570 0.028700 O\n0.436430 0.235200 0.471300 O\n0.579229 0.784278 0.026535 O\n0.250179 0.884345 0.879769 O\n0.115655 0.749821 0.620231 O\n0.292157 0.900247 0.377085 O\n0.187455 0.385835 0.236029 O\n0.235200 0.436430 0.971300 O\n0.884345 0.250179 0.379769 O\n0.891378 0.903307 0.620649 O\n0.749821 0.115655 0.120231 O\n",
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"elements": [
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"P",
"O"
],
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"density_atomic": 0.07537200718585121,
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"formula_full": "Li4 Fe4 P8 O28",
"formula_reduced": "LiFeP2O7",
"formula_anonymous": "ABC2D7",
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"updated_at": "2021-11-28T01:35:29.381000Z",
"spacegroup": 15
},
{
"id": "mp-1205148",
"created_at": "2022-09-04T14:41:56.581010Z",
"structure_string": "Pr2 H40 S8 N10 O32\n1.0\n11.588522 4.136442 0.000000\n-11.588522 4.136442 0.000000\n0.000000 3.048598 8.941675\nPr H S N O\n2 40 8 10 32\ndirect\n0.074837 0.923324 0.501833 Pr\n0.923324 0.074837 0.001833 Pr\n0.274694 0.657357 0.625206 H\n0.657357 0.274694 0.125206 H\n0.215284 0.694037 0.492347 H\n0.694037 0.215284 0.992347 H\n0.432754 0.835934 0.471858 H\n0.835934 0.432754 0.971858 H\n0.291566 0.628915 0.456008 H\n0.628915 0.291566 0.956008 H\n0.542252 0.723386 0.853596 H\n0.723386 0.542252 0.353596 H\n0.633669 0.680067 0.779093 H\n0.680067 0.633669 0.279093 H\n0.585609 0.747673 0.667568 H\n0.747673 0.585609 0.167568 H\n0.414399 0.540835 0.792407 H\n0.540835 0.414399 0.292407 H\n0.269572 0.453524 0.150499 H\n0.453524 0.269572 0.650499 H\n0.312797 0.362178 0.225584 H\n0.362178 0.312797 0.725584 H\n0.253078 0.417516 0.335501 H\n0.417516 0.253078 0.835501 H\n0.456020 0.583843 0.205571 H\n0.583843 0.456020 0.705571 H\n0.970291 0.375808 0.208533 H\n0.375808 0.970291 0.708533 H\n0.887451 0.336414 0.390004 H\n0.336414 0.887451 0.890004 H\n0.914968 0.224332 0.342609 H\n0.224332 0.914968 0.842609 H\n0.756961 0.178209 0.301179 H\n0.178209 0.756961 0.801179 H\n0.630526 0.042765 0.799098 H\n0.042765 0.630526 0.299098 H\n0.663827 0.109391 0.614538 H\n0.109391 0.663827 0.114538 H\n0.773220 0.081546 0.671240 H\n0.081546 0.773220 0.171240 H\n0.829047 0.251125 0.693213 H\n0.251125 0.829047 0.193213 H\n0.101791 0.225320 0.630188 S\n0.225320 0.101791 0.130188 S\n0.776092 0.899368 0.372566 S\n0.899368 0.776092 0.872566 S\n0.469070 0.114675 0.421622 S\n0.114675 0.469070 0.921622 S\n0.882096 0.529742 0.584714 S\n0.529742 0.882096 0.084714 S\n0.303587 0.704050 0.510415 N\n0.704050 0.303587 0.010415 N\n0.543004 0.671476 0.774443 N\n0.671476 0.543004 0.274443 N\n0.324335 0.455156 0.227990 N\n0.455156 0.324335 0.727990 N\n0.883210 0.279160 0.313869 N\n0.279160 0.883210 0.813869 N\n0.723502 0.120082 0.691519 N\n0.120082 0.723502 0.191519 N\n0.906421 0.065647 0.719901 O\n0.065647 0.906421 0.219901 O\n0.156104 0.172267 0.543240 O\n0.172267 0.156104 0.043240 O\n0.202010 0.301348 0.744729 O\n0.301348 0.202010 0.244729 O\n0.141974 0.358228 0.525150 O\n0.358228 0.141974 0.025150 O\n0.829745 0.845155 0.458996 O\n0.845155 0.829745 0.958996 O\n0.692227 0.792616 0.263213 O\n0.792616 0.692227 0.763213 O\n0.936805 0.092878 0.277709 O\n0.092878 0.936805 0.777709 O\n0.650729 0.867863 0.478334 O\n0.867863 0.650729 0.978334 O\n0.396750 0.151301 0.513214 O\n0.151301 0.396750 0.013214 O\n0.505437 0.048857 0.522185 O\n0.048857 0.505437 0.022185 O\n0.638585 0.280268 0.302678 O\n0.280268 0.638585 0.802678 O\n0.323336 0.971403 0.360100 O\n0.971403 0.323336 0.860100 O\n0.845350 0.601693 0.491516 O\n0.601693 0.845350 0.991516 O\n0.718691 0.360463 0.702288 O\n0.360463 0.718691 0.202288 O\n0.026287 0.678583 0.644866 O\n0.678583 0.026287 0.144866 O\n0.955731 0.500330 0.482970 O\n0.500330 0.955731 0.982970 O\n",
"nsites": 92,
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"density_atomic": 0.1073208150526318,
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"volume_molar": 5.611344599877152,
"formula_full": "Pr2 H40 S8 N10 O32",
"formula_reduced": "PrH20S4N5O16",
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"energy": -545.7061107500001,
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"spacegroup": 9
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{
"id": "mp-1196233",
"created_at": "2022-09-04T14:41:56.532847Z",
"structure_string": "Eu4 Al12 Pb8 O32\n1.0\n9.609590 0.000000 0.000000\n0.000000 9.609590 0.000000\n0.000000 0.000000 9.609590\nEu Al Pb O\n4 12 8 32\ndirect\n0.250000 0.750000 0.250000 Eu\n0.750000 0.750000 0.750000 Eu\n0.750000 0.250000 0.250000 Eu\n0.250000 0.250000 0.750000 Eu\n0.000000 0.500000 0.250000 Al\n0.000000 0.500000 0.750000 Al\n0.750000 0.500000 0.000000 Al\n0.250000 0.500000 0.000000 Al\n0.250000 0.000000 0.500000 Al\n0.750000 0.000000 0.500000 Al\n0.000000 0.750000 0.500000 Al\n0.000000 0.250000 0.500000 Al\n0.500000 0.250000 0.000000 Al\n0.500000 0.750000 0.000000 Al\n0.500000 0.000000 0.750000 Al\n0.500000 0.000000 0.250000 Al\n0.365046 0.634954 0.634954 Pb\n0.634954 0.634954 0.365046 Pb\n0.634954 0.365046 0.634954 Pb\n0.365046 0.365046 0.365046 Pb\n0.134954 0.865046 0.865046 Pb\n0.865046 0.865046 0.134954 Pb\n0.865046 0.134954 0.865046 Pb\n0.134954 0.134954 0.134954 Pb\n0.890210 0.109790 0.109790 O\n0.109790 0.109790 0.890210 O\n0.109790 0.890210 0.109790 O\n0.890210 0.890210 0.890210 O\n0.609790 0.390210 0.390210 O\n0.390210 0.390210 0.609790 O\n0.390210 0.609790 0.390210 O\n0.609790 0.609790 0.609790 O\n0.156989 0.488084 0.843011 O\n0.843011 0.488084 0.156989 O\n0.843011 0.511916 0.843011 O\n0.156989 0.511916 0.156989 O\n0.843011 0.156989 0.488084 O\n0.156989 0.843011 0.488084 O\n0.843011 0.843011 0.511916 O\n0.156989 0.156989 0.511916 O\n0.488084 0.843011 0.156989 O\n0.488084 0.156989 0.843011 O\n0.511916 0.843011 0.843011 O\n0.511916 0.156989 0.156989 O\n0.343011 0.011916 0.656989 O\n0.656989 0.011916 0.343011 O\n0.656989 0.988084 0.656989 O\n0.343011 0.988084 0.343011 O\n0.656989 0.343011 0.011916 O\n0.343011 0.656989 0.011916 O\n0.656989 0.656989 0.988084 O\n0.343011 0.343011 0.988084 O\n0.011916 0.656989 0.343011 O\n0.011916 0.343011 0.656989 O\n0.988084 0.656989 0.656989 O\n0.988084 0.343011 0.343011 O\n",
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"formula_full": "Eu4 Al12 Pb8 O32",
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{
"id": "mp-754166",
"created_at": "2022-09-04T14:41:36.214881Z",
"structure_string": "Li4 Ti2 Fe4 O10\n1.0\n-6.026323 6.893061 -2.549738\n2.978299 1.696987 -2.446108\n-0.031551 -1.608207 -4.777568\nLi Ti Fe O\n4 2 4 10\ndirect\n0.901450 0.300244 0.399113 Li\n0.698460 0.899783 0.200863 Li\n0.504473 0.504287 0.991622 Li\n0.095558 0.695715 0.608407 Li\n0.608648 0.206791 0.589288 Ti\n0.991252 0.993137 0.010419 Ti\n0.799959 0.600088 0.799915 Fe\n0.300197 0.099713 0.800631 Fe\n0.210779 0.387541 0.225915 Fe\n0.388936 0.812606 0.373727 Fe\n0.800060 0.100056 0.799972 O\n0.901199 0.809777 0.380634 O\n0.698833 0.390299 0.219280 O\n0.503858 0.011293 0.977070 O\n0.601997 0.701106 0.596426 O\n0.419083 0.301080 0.396989 O\n0.300037 0.599960 0.800079 O\n0.096383 0.188661 0.623013 O\n0.180799 0.898870 0.203069 O\n0.998038 0.498992 0.003567 O\n",
"nsites": 20,
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"elements": [
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"formula_full": "Li4 Ti2 Fe4 O10",
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"spacegroup": 12
},
{
"id": "mp-1210536",
"created_at": "2022-09-04T14:41:36.215550Z",
"structure_string": "Na6 Dy2 Br12\n1.0\n7.736783 0.000000 0.000000\n0.000000 7.414751 0.000000\n0.000000 7.379113 10.917596\nNa Dy Br\n6 2 12\ndirect\n0.500000 0.500000 0.000000 Na\n0.000000 0.500000 0.500000 Na\n0.059565 0.729127 0.756998 Na\n0.940435 0.270873 0.243002 Na\n0.559565 0.270873 0.743002 Na\n0.440435 0.729127 0.256998 Na\n0.500000 0.000000 0.500000 Dy\n0.000000 0.000000 0.000000 Dy\n0.804545 0.750710 0.576889 Br\n0.195455 0.249290 0.423111 Br\n0.304545 0.249290 0.923111 Br\n0.695455 0.750710 0.076889 Br\n0.436533 0.891324 0.739686 Br\n0.563467 0.108676 0.260314 Br\n0.936533 0.108676 0.760314 Br\n0.063467 0.891324 0.239686 Br\n0.319270 0.625779 0.561575 Br\n0.680730 0.374221 0.438425 Br\n0.819270 0.374221 0.938425 Br\n0.180730 0.625779 0.061575 Br\n",
"nsites": 20,
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"elements": [
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],
"chemical_system": "Br-Dy-Na",
"density": 3.769636833713852,
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"volume": 626.3023001554359,
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"formula_full": "Na6 Dy2 Br12",
"formula_reduced": "Na3DyBr6",
"formula_anonymous": "AB3C6",
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"created_at": "2022-09-04T14:42:22.000140Z",
"structure_string": "Mg32 P16 H16 O80\n1.0\n13.012617 0.000000 0.000000\n0.000000 9.792624 0.000000\n0.000000 3.865149 11.582158\nMg P H O\n32 16 16 80\ndirect\n0.927359 0.550721 0.084352 Mg\n0.427359 0.449279 0.415648 Mg\n0.072641 0.449279 0.915648 Mg\n0.572641 0.550721 0.584352 Mg\n0.930641 0.470563 0.398780 Mg\n0.430641 0.529437 0.101220 Mg\n0.069359 0.529437 0.601220 Mg\n0.569359 0.470563 0.898780 Mg\n0.820150 0.042825 0.077915 Mg\n0.320150 0.957175 0.422085 Mg\n0.179850 0.957175 0.922085 Mg\n0.679850 0.042825 0.577915 Mg\n0.823021 0.970120 0.390856 Mg\n0.323021 0.029880 0.109144 Mg\n0.176979 0.029880 0.609144 Mg\n0.676979 0.970120 0.890856 Mg\n0.978867 0.190933 0.811948 Mg\n0.478867 0.809067 0.688052 Mg\n0.021133 0.809067 0.188052 Mg\n0.521133 0.190933 0.311948 Mg\n0.998740 0.786367 0.696582 Mg\n0.498740 0.213633 0.803418 Mg\n0.001260 0.213633 0.303418 Mg\n0.501260 0.786367 0.196582 Mg\n0.769187 0.305014 0.682222 Mg\n0.269187 0.694986 0.817778 Mg\n0.230813 0.694986 0.317778 Mg\n0.730813 0.305014 0.182222 Mg\n0.749283 0.708457 0.805180 Mg\n0.249283 0.291543 0.694820 Mg\n0.250717 0.291543 0.194820 Mg\n0.750717 0.708457 0.305180 Mg\n0.922669 0.114525 0.574810 P\n0.422669 0.885475 0.925190 P\n0.077331 0.885475 0.425190 P\n0.577331 0.114525 0.074810 P\n0.929526 0.878899 0.925232 P\n0.429526 0.121101 0.574768 P\n0.070474 0.121101 0.074768 P\n0.570474 0.878899 0.425232 P\n0.825447 0.381535 0.925382 P\n0.325447 0.618465 0.574618 P\n0.174553 0.618465 0.074618 P\n0.674553 0.381535 0.425382 P\n0.821261 0.620432 0.577629 P\n0.321261 0.379568 0.922371 P\n0.178739 0.379568 0.422371 P\n0.678739 0.620432 0.077629 P\n0.040139 0.460115 0.240657 H\n0.540139 0.539885 0.259343 H\n0.959861 0.539885 0.759343 H\n0.459861 0.460115 0.740657 H\n0.921884 0.727331 0.364294 H\n0.421884 0.272669 0.135706 H\n0.078116 0.272669 0.635706 H\n0.578116 0.727331 0.864294 H\n0.829688 0.229066 0.355520 H\n0.329688 0.770934 0.144480 H\n0.170312 0.770934 0.644480 H\n0.670312 0.229066 0.855520 H\n0.709881 0.959730 0.236174 H\n0.209881 0.040270 0.263826 H\n0.290119 0.040270 0.763826 H\n0.790119 0.959730 0.736174 H\n0.885975 0.169608 0.675603 O\n0.385975 0.830392 0.824397 O\n0.114025 0.830392 0.324397 O\n0.614025 0.169608 0.175603 O\n0.952856 0.243657 0.468390 O\n0.452856 0.756343 0.031610 O\n0.047144 0.756343 0.531610 O\n0.547144 0.243657 0.968390 O\n0.984467 0.986398 0.379288 O\n0.484467 0.013602 0.120712 O\n0.015533 0.013602 0.620712 O\n0.515533 0.986398 0.879288 O\n0.835091 0.027456 0.541519 O\n0.335091 0.972544 0.958481 O\n0.164909 0.972544 0.458481 O\n0.664909 0.027456 0.041519 O\n0.906716 0.799191 0.836976 O\n0.406716 0.200809 0.663024 O\n0.093284 0.200809 0.163024 O\n0.593284 0.799191 0.336976 O\n0.947605 0.767468 0.047131 O\n0.447605 0.232532 0.452869 O\n0.052395 0.232532 0.952869 O\n0.552395 0.767468 0.547131 O\n0.974395 0.022604 0.114851 O\n0.474395 0.977396 0.385149 O\n0.025605 0.977396 0.885149 O\n0.525605 0.022604 0.614851 O\n0.839905 0.982061 0.932546 O\n0.339905 0.017939 0.567454 O\n0.160095 0.017939 0.067454 O\n0.660095 0.982061 0.432546 O\n0.858184 0.318838 0.828002 O\n0.358184 0.681162 0.671998 O\n0.141816 0.681162 0.171998 O\n0.641816 0.318838 0.328002 O\n0.797186 0.258485 0.037793 O\n0.297186 0.741515 0.462207 O\n0.202814 0.741515 0.962207 O\n0.702814 0.258485 0.537793 O\n0.767945 0.482119 0.382752 O\n0.267945 0.517881 0.117248 O\n0.232055 0.517881 0.617248 O\n0.732055 0.482119 0.882752 O\n0.916087 0.467505 0.953145 O\n0.416087 0.532495 0.546855 O\n0.083913 0.532495 0.046855 O\n0.583913 0.467505 0.453145 O\n0.846751 0.688593 0.673221 O\n0.346751 0.311407 0.826779 O\n0.153249 0.311407 0.326779 O\n0.653249 0.688593 0.173221 O\n0.797513 0.741898 0.463588 O\n0.297513 0.258102 0.036412 O\n0.202487 0.258102 0.536412 O\n0.702487 0.741898 0.963588 O\n0.773744 0.518954 0.117726 O\n0.273744 0.481046 0.382274 O\n0.226256 0.481046 0.882274 O\n0.726256 0.518954 0.617726 O\n0.909984 0.521584 0.559594 O\n0.409984 0.478416 0.940406 O\n0.090016 0.478416 0.440406 O\n0.590016 0.521584 0.059594 O\n0.967508 0.432978 0.245161 O\n0.467508 0.567022 0.254839 O\n0.032492 0.567022 0.754839 O\n0.532492 0.432978 0.745161 O\n0.917498 0.688321 0.299907 O\n0.417498 0.311679 0.200093 O\n0.082502 0.311679 0.700093 O\n0.582502 0.688321 0.799907 O\n0.837461 0.189316 0.291928 O\n0.337461 0.810684 0.208072 O\n0.162539 0.810684 0.708072 O\n0.662539 0.189316 0.791928 O\n0.781396 0.927483 0.240683 O\n0.281396 0.072517 0.259317 O\n0.218604 0.072517 0.759317 O\n0.718604 0.927483 0.740683 O\n",
"nsites": 144,
"nelements": 4,
"elements": [
"Mg",
"P",
"H",
"O"
],
"chemical_system": "H-Mg-O-P",
"density": 2.890885267349271,
"density_atomic": 0.09756842175798548,
"volume": 1475.8873558207815,
"volume_molar": 6.17222319628955,
"formula_full": "Mg32 P16 H16 O80",
"formula_reduced": "Mg2PHO5",
"formula_anonymous": "ABC2D5",
"energy": -984.22009029,
"energy_per_atom": -6.834861738125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -929.26009029,
"band_gap": 5.266400000000001,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 2.84e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:49.629000Z",
"spacegroup": 14
}
]
}