mp_ID stringlengths 4 10 | x float64 -10.28 17.7 | y float64 -12.01 23.9 | z float64 -8.99 7.96 | type stringclasses 2
values | formula stringlengths 2 26 | n_atoms int64 1 444 | spacegroup int64 1 230 | volume float64 5.61 20.1k |
|---|---|---|---|---|---|---|---|---|
mp-1194315 | -5.778774 | -1.434894 | 1.182478 | other | Ni14P14 | 28 | 36 | 346.28 |
mp-632229 | 2.15518 | 2.389682 | -3.807709 | other | H2Br2 | 4 | 36 | 95.96 |
mp-754401 | 12.692881 | 7.209518 | 0.814918 | other | Al4O6 | 10 | 36 | 131.07 |
mp-715438 | 9.449188 | 13.288923 | -0.745425 | other | Fe6O8 | 14 | 36 | 143.55 |
mp-2798 | -3.048277 | -3.792592 | 0.763431 | other | Si12P12 | 24 | 36 | 520.85 |
mp-1194076 | -3.068414 | -2.293724 | -5.136014 | other | Yb12S18 | 30 | 36 | 684.24 |
mp-568856 | -6.214122 | -1.858224 | 1.327838 | other | Mn12As8 | 20 | 36 | 288.05 |
mp-571636 | 1.037911 | 2.263258 | -5.375839 | other | In2Cl2 | 4 | 36 | 124.69 |
mp-2831286 | 10.67829 | 12.406505 | 0.126861 | other | Mn4O4 | 8 | 36 | 111.35 |
mp-29721 | 6.265061 | 0.211825 | -3.341201 | other | B12H20 | 32 | 36 | 307.61 |
mp-726658 | 7.625763 | 2.765207 | -1.629841 | other | N2F2 | 4 | 36 | 103.36 |
mp-1071868 | 6.156035 | 3.88403 | -3.33155 | other | K2N4 | 6 | 36 | 90.42 |
mp-717 | 13.903451 | 4.318634 | -2.295901 | other | B4O6 | 10 | 36 | 74.62 |
mp-23297 | 8.311014 | 2.639425 | -1.140463 | other | Br2F6 | 8 | 36 | 125.08 |
mp-1103186 | -3.474538 | -1.135829 | -4.801453 | other | As6S6 | 12 | 36 | 259.21 |
mp-567687 | -1.054435 | 2.602461 | -2.998902 | other | Cr2I4 | 6 | 36 | 232.87 |
mp-1084851 | -4.278225 | -4.978186 | -3.417325 | other | Ce12Se24 | 36 | 36 | 3,035.47 |
mp-23292 | -0.498186 | 1.292758 | -4.198184 | other | Hg2Br4 | 6 | 36 | 207.27 |
mp-1078791 | 6.12982 | 2.367785 | -2.980149 | other | C4N6 | 10 | 36 | 67.48 |
mp-556218 | 15.509625 | 5.712881 | 0.349111 | other | Si12O24 | 36 | 36 | 615.73 |
mp-1078644 | 11.072952 | 9.161427 | 0.307849 | other | Sn4O4 | 8 | 36 | 152.75 |
mp-1185953 | -3.759224 | -1.068613 | -5.682623 | other | Mg2S4 | 6 | 36 | 122.96 |
mp-7670 | -4.62978 | -2.674616 | -3.741041 | other | K4Se6 | 10 | 36 | 310.29 |
mp-1194759 | -5.657805 | -5.547285 | 3.419336 | other | Ba14Ge78 | 92 | 36 | 2,218.42 |
mp-697111 | 10.627162 | 3.329504 | -4.142519 | other | H8O4 | 12 | 36 | 115.07 |
mp-8073 | -6.957845 | -3.922455 | 1.188327 | other | As4Pd8 | 12 | 36 | 188.48 |
mp-632326 | 3.365267 | 2.638299 | -4.035695 | original | H2Cl2 | 4 | 36 | 80.24 |
mp-1078828 | 0.38721 | 2.282351 | 2.001293 | other | Os4N4 | 8 | 36 | 84.96 |
mp-673658 | 10.625662 | 3.36022 | -4.041246 | other | H8O4 | 12 | 36 | 102.71 |
mp-1445941 | 2.188344 | 2.37507 | 1.127902 | other | Bi2N2 | 4 | 36 | 74.83 |
mp-1079600 | -3.433355 | -1.192616 | -5.159492 | other | Cs4S6 | 10 | 36 | 351.87 |
mp-1247786 | -4.241198 | -4.456504 | -3.397394 | other | Ce4Se8 | 12 | 36 | 569.88 |
mp-1182330 | -3.257715 | -1.148709 | -4.840149 | other | As6S6 | 12 | 36 | 308.13 |
mp-32669 | -4.028996 | -1.21249 | -5.358038 | other | Ag4S2 | 6 | 36 | 128.13 |
mp-7449 | -4.565893 | -2.729953 | -3.592622 | other | Cs4Se6 | 10 | 36 | 391.73 |
mp-1095181 | 4.808228 | 3.308565 | -3.436099 | other | N6Cl2 | 8 | 36 | 197.31 |
mp-1042110 | 9.731592 | 10.252234 | -3.449172 | other | Re4O14 | 18 | 36 | 418.92 |
mp-1194071 | -3.138319 | -2.207532 | -5.086382 | other | Yb12S18 | 30 | 36 | 723.41 |
mp-7446 | -3.441974 | -1.251092 | -5.266585 | other | Rb4S6 | 10 | 36 | 306.63 |
mp-557264 | 15.609528 | 5.664577 | 0.397004 | other | Si16O32 | 48 | 36 | 773.33 |
mp-7667 | -3.414963 | -1.276534 | -5.355851 | other | K4S6 | 10 | 36 | 272.41 |
mp-569727 | -6.845815 | -4.524517 | 0.277892 | other | Bi8Pd8 | 16 | 36 | 351.69 |
mp-685146 | -6.125805 | -3.448958 | -2.391686 | other | Cd2Te2 | 4 | 36 | 145.52 |
mp-30380 | -8.575 | -5.941234 | 2.217051 | other | Ga4Au8 | 12 | 36 | 206.42 |
mp-28832 | -6.14948 | -1.884462 | 1.222539 | other | Mn10As8 | 18 | 36 | 271.66 |
mp-632296 | 9.502485 | 2.830122 | -2.320329 | other | H2F2 | 4 | 36 | 38.59 |
mp-1887 | -5.588824 | -1.091886 | 2.077105 | other | Mo2P4 | 6 | 36 | 88.45 |
mp-1213763 | 8.220581 | 2.702458 | -1.120825 | other | Cl2F10 | 12 | 36 | 165.42 |
mp-542106 | -6.952405 | -4.112458 | 0.764145 | other | Sb4Pd8 | 12 | 36 | 211.27 |
mp-11328 | -5.557056 | -1.169667 | 2.023963 | other | P4W2 | 6 | 36 | 88.67 |
mp-1080271 | -4.063719 | -2.814734 | -4.098738 | other | Cs4Se2 | 6 | 36 | 280.69 |
mp-607960 | -7.880872 | -6.324851 | 2.457662 | other | Cd54Pd16 | 70 | 36 | 2,688.38 |
mp-2214678 | 11.969291 | 13.452123 | -2.514664 | other | V4O8 | 12 | 36 | 140.07 |
mp-554074 | -4.069727 | -0.060022 | -3.77134 | other | Nb4S8 | 12 | 36 | 371.24 |
mp-27987 | 8.165378 | 2.583963 | -1.098942 | other | Br2F10 | 12 | 36 | 177.02 |
mp-1197413 | -5.660052 | -4.837139 | 2.165718 | other | Sc36Te8 | 44 | 36 | 1,049.96 |
mp-23173 | -0.900771 | 2.332768 | -3.197427 | other | Hg2I4 | 6 | 36 | 259.03 |
mp-1219986 | -5.544179 | -1.720285 | -3.255486 | other | Ni12Se10 | 22 | 36 | 356.23 |
mp-1073644 | -2.538019 | -5.496148 | 6.990186 | other | Mg4Si8 | 12 | 4 | 236.93 |
mp-1016070 | 0.693125 | 3.065177 | 1.572708 | other | Cr4N8 | 12 | 4 | 246.43 |
mp-685174 | -0.438875 | 1.206288 | -4.428238 | other | In64Br96 | 160 | 4 | 5,834.92 |
mp-1096549 | -3.875165 | -4.712259 | 5.791289 | other | Si16Ge16 | 32 | 4 | 702.56 |
mp-760218 | 10.162229 | 2.57201 | 0.688953 | other | V8F28 | 36 | 4 | 504.3 |
mp-1207665 | -3.100741 | -7.917012 | 2.104395 | other | Y2C2 | 4 | 4 | 937.61 |
mp-685168 | 8.957123 | 1.191779 | 1.060856 | other | Be16F32 | 48 | 4 | 553.68 |
mp-12177 | 9.840902 | 9.493118 | -1.95859 | other | Te4O10 | 14 | 4 | 196.85 |
mp-1182418 | 6.582715 | 6.124362 | -3.655878 | other | Br4O16 | 20 | 4 | 350.32 |
mp-557082 | 10.485953 | 3.499104 | -4.118848 | other | H24O12 | 36 | 4 | 250.81 |
mp-1214291 | 6.962321 | 8.559087 | -2.988693 | other | Be12O24 | 36 | 4 | 444.19 |
mp-1101328 | 9.776711 | 12.44534 | -4.276075 | other | V18O44 | 62 | 4 | 767.23 |
mp-1075504 | -2.234125 | -6.04463 | 7.524936 | other | Mg10Si12 | 22 | 4 | 394.05 |
mp-1182293 | 6.409091 | 5.854199 | -3.923014 | other | Br4O16 | 20 | 4 | 501.02 |
mp-1221991 | -7.126024 | -0.272051 | 4.171136 | other | Mn14Fe6 | 20 | 4 | 222.09 |
mp-726151 | 3.956828 | 3.346014 | -3.692729 | other | N16Cl4 | 20 | 4 | 330.33 |
mp-760309 | 10.319627 | 0.291714 | -0.113775 | other | Mn8F28 | 36 | 4 | 458.23 |
mp-23206 | -6.847334 | -4.526486 | 0.2829 | other | Bi8Pd8 | 16 | 4 | 351.14 |
mp-616580 | 11.229405 | 9.098325 | 0.740789 | other | U10O30 | 40 | 4 | 614.68 |
mp-1182215 | 7.509092 | 7.092346 | -4.464565 | other | Be4O8 | 12 | 4 | 152.13 |
mp-1073722 | -2.355749 | -6.820135 | 7.701041 | other | Mg12Si12 | 24 | 4 | 443.41 |
mp-555891 | 15.658228 | 5.634215 | 0.356537 | other | Si4O8 | 12 | 4 | 200.28 |
mp-567596 | -4.723297 | -2.748467 | -4.037197 | other | In12Se14 | 26 | 4 | 704.04 |
mp-690 | -2.635156 | -0.472145 | -4.957124 | other | P8S10 | 18 | 4 | 469 |
mp-776081 | 8.897185 | 8.589972 | 0.241926 | other | K4O2 | 6 | 4 | 132.22 |
mp-752907 | 9.674839 | 2.299469 | -0.166139 | other | V4F20 | 24 | 4 | 364.59 |
mp-1214378 | 5.816447 | 2.617847 | -3.45548 | other | C32S16 | 48 | 4 | 966.54 |
mp-1798334 | 2.190027 | 2.374545 | 1.12898 | other | Bi2N2 | 4 | 4 | 74.82 |
mp-684642 | 5.147001 | 3.155365 | -3.996257 | other | S18N18 | 36 | 4 | 728.97 |
mp-1074751 | -3.727946 | -8.3503 | 7.24586 | other | Mg8Si4 | 12 | 4 | 252.57 |
mp-1074641 | -3.648694 | -8.338967 | 7.307332 | other | Mg8Si4 | 12 | 4 | 235.08 |
mp-30168 | 7.852233 | 0.488111 | -4.362251 | other | H68C38 | 106 | 4 | 942.58 |
mp-571006 | -3.571311 | -3.959171 | 0.56245 | other | Yb4P20 | 24 | 4 | 501.46 |
mp-850411 | -5.63353 | -0.809265 | -3.944891 | other | Fe14S16 | 30 | 4 | 396.02 |
mp-1180808 | 5.959636 | 5.264061 | -4.430261 | other | N8O18 | 26 | 4 | 438.58 |
mp-542817 | -7.339308 | -3.876042 | 3.445086 | other | U8Pt8 | 16 | 4 | 350.96 |
mp-1080338 | -4.283279 | -4.972404 | -3.415405 | other | Ce4Se8 | 12 | 4 | 932.82 |
mp-972808 | 15.441597 | 5.744729 | 0.331374 | other | Si4O8 | 12 | 4 | 177.63 |
mp-1178720 | 7.069178 | 7.435723 | -4.032798 | other | Zn4O8 | 12 | 4 | 135.07 |
mp-560025 | -3.967896 | -1.309364 | -5.38659 | other | Ag4S2 | 6 | 4 | 127.46 |
mp-1173466 | 5.007395 | 3.12576 | -3.996442 | other | S18N18 | 36 | 4 | 837.13 |
mp-1178865 | 7.43725 | 7.070848 | -3.84713 | other | W4O20 | 24 | 4 | 489.11 |
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