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-777394 | 2.572942 | 2.567907 | 1.089293 | other | Sn16N16O8 | 40 | 164 | 570.4 |
mp-1246885 | 1.962115 | 2.125813 | 1.285709 | other | Sr1Pb2N2 | 5 | 164 | 105.42 |
mp-505365 | 12.974681 | 10.389469 | 2.24787 | other | Mg3Nb6O11 | 20 | 164 | 240.75 |
mp-1228679 | -8.449153 | -3.063549 | 2.507636 | other | Ba1B4Pt6 | 11 | 164 | 176.97 |
mp-569115 | -6.449419 | -6.800259 | 3.65201 | other | Li8Zn4Ge4 | 16 | 164 | 253.94 |
mp-12672 | 7.334341 | 8.439844 | -1.628367 | other | Yb2S1O2 | 5 | 164 | 86.82 |
mp-1175490 | 6.408884 | 20.814356 | -0.308754 | other | Li7Mn5O12 | 24 | 164 | 229.5 |
mp-1225845 | -8.422585 | -5.227545 | 2.670408 | other | Cu2Sn2Pd1 | 5 | 164 | 93.25 |
mp-1224878 | -6.169504 | -2.318754 | -0.864018 | other | Ga2Ni5Te4 | 11 | 164 | 200.57 |
mp-1216822 | -4.872985 | -3.723186 | 1.056924 | original | U3P2S1 | 6 | 164 | 135.48 |
mp-10189 | -5.7563 | -2.861713 | -1.774107 | other | Li1Ti1Te2 | 4 | 164 | 95.41 |
mp-754655 | 7.608677 | 8.466134 | 0.242238 | other | Eu2Se1O2 | 5 | 164 | 94.44 |
mp-768908 | 11.270288 | 8.194038 | 2.839261 | other | Ho2Te1O2 | 5 | 164 | 94.67 |
mp-1197803 | -7.314126 | -5.281219 | 3.185797 | other | Er7Co6Sn23 | 36 | 164 | 962.93 |
mp-1217980 | -5.339456 | -1.496097 | 4.583283 | other | Ta2Be8Mo2 | 12 | 164 | 131.52 |
mp-7297 | 8.417725 | 0.895278 | 1.062065 | other | Cs2Sn1F6 | 9 | 164 | 172.24 |
mp-17438 | 8.767391 | 1.257906 | 1.069555 | other | Na6Ge3F18 | 27 | 164 | 370.18 |
mp-4511 | 10.598003 | 8.058628 | 2.763207 | other | La2S1O2 | 5 | 164 | 98.92 |
mp-1226520 | -3.069451 | -3.82293 | -3.210788 | other | Ce1Th2S3 | 6 | 164 | 142.04 |
mp-1226535 | 11.47632 | 8.519723 | 2.202697 | other | Ce1U2O6 | 9 | 164 | 121.68 |
mp-13976 | 7.348063 | 8.46181 | -1.291082 | other | Yb2Se1O2 | 5 | 164 | 93.35 |
mp-1222169 | -5.85249 | -7.349011 | 5.814397 | other | Mg4Al8Zn6 | 18 | 164 | 348.19 |
mp-752947 | -3.83521 | -0.652728 | -4.995584 | other | Na1Ti1S2 | 4 | 164 | 73.66 |
mp-1245437 | 1.125413 | 2.392174 | 1.526381 | other | Sr1Ni2N2 | 5 | 164 | 61.17 |
mp-1173891 | 4.139782 | 18.361286 | -1.841216 | other | Li4Co2O6 | 12 | 164 | 107.8 |
mp-1226271 | -6.494682 | -2.912555 | 0.646401 | other | Cr1Fe3Sb4 | 8 | 164 | 143.45 |
mp-1024054 | -5.351741 | -0.751543 | -4.4353 | other | Fe4Si2S8 | 14 | 164 | 215.01 |
mp-1018780 | -5.907794 | -5.899533 | 0.863372 | other | Li3Sm1Bi2 | 6 | 164 | 140 |
mp-31908 | 12.935867 | 10.89486 | 2.147649 | other | Mn6Nb12O22 | 40 | 164 | 497.01 |
mp-1216670 | -5.730503 | -2.202883 | 1.957637 | other | Ti1V1As2 | 4 | 164 | 67.2 |
mp-510456 | 11.605342 | 11.047737 | -3.954923 | other | Zr1Mo2O8 | 11 | 164 | 180 |
mp-2227138 | -5.338531 | -0.183061 | -5.779166 | other | Mg1Cr2S4 | 7 | 164 | 128.75 |
mp-1246084 | 1.919998 | 2.119099 | 1.347986 | other | Rb2Zr1N2 | 5 | 164 | 112.55 |
mp-1245762 | 1.881444 | 2.405519 | 1.052838 | other | Cd1Pb2N2 | 5 | 164 | 99.03 |
mp-4343 | -5.472004 | -4.241179 | 0.479751 | other | Sr1Mn2As2 | 5 | 164 | 105.79 |
mp-1206775 | -4.822755 | -3.425257 | -3.847416 | other | Yb1Cu1Se2 | 4 | 164 | 84.49 |
mp-21071 | 7.400234 | 8.864464 | -0.016383 | other | Eu2S1O2 | 5 | 164 | 89.13 |
mp-1220456 | -6.316298 | -1.073622 | 4.255942 | other | Nb2Al2Cr8 | 12 | 164 | 162.28 |
mp-7768 | 2.24696 | 1.802092 | 1.576752 | other | Th2Se1N2 | 5 | 164 | 101.65 |
mp-4041 | -6.140907 | -5.24424 | 4.817605 | other | Yb1Al2Ge2 | 5 | 164 | 107.31 |
mp-1018770 | -5.908389 | -5.876646 | 0.856769 | other | Li3Pr1Bi2 | 6 | 164 | 144.19 |
mp-1048819 | 12.816696 | 10.908383 | 1.720074 | other | Ti12Al4O24 | 40 | 164 | 445.82 |
mp-1232292 | -6.011771 | -5.120295 | 5.042311 | other | Mg1Al2Ge2 | 5 | 164 | 98.02 |
mp-9272 | -4.307352 | -1.373568 | -4.460813 | other | Tl2Pt4S6 | 12 | 164 | 268.94 |
mp-3821 | 8.412786 | 1.274025 | 0.069465 | other | K2Pt1F6 | 9 | 164 | 131.17 |
mp-10010 | -6.410647 | -1.068869 | 4.060427 | other | Al1Co2Si2 | 5 | 164 | 60.1 |
mp-626680 | 13.260766 | 6.676852 | -3.221841 | other | Fe1H2O2 | 5 | 164 | 40.88 |
mp-1028514 | -7.19387 | 1.664326 | -4.526695 | other | Mo2W2Se8 | 12 | 164 | 361.97 |
mp-1246351 | 0.637157 | 2.317566 | 2.037576 | other | V2S1N2 | 5 | 164 | 56.98 |
mp-1211155 | -4.445888 | -4.607846 | 6.083725 | other | La3Al4Si6 | 13 | 164 | 282.15 |
mp-1225794 | -7.107166 | 1.833753 | -5.001898 | other | Cu2W2Se4 | 8 | 164 | 167.56 |
mp-12856 | -4.409508 | -4.705752 | 6.12873 | other | Pr1Al2Si2 | 5 | 164 | 106.47 |
mp-7824 | 8.933975 | 1.968735 | 1.10307 | other | K2Re1F6 | 9 | 164 | 133.32 |
mp-1207385 | -1.916803 | 0.333918 | 2.334848 | other | Zr2Al8C8 | 18 | 164 | 215.6 |
mp-3862 | -5.898475 | -5.361839 | 4.864968 | other | Ca1Al2Ge2 | 5 | 164 | 107.71 |
mp-1101998 | -6.396864 | -1.141602 | 1.861821 | other | Li4Fe4As4 | 12 | 164 | 148.76 |
mp-571566 | -4.144621 | -5.238746 | 5.341105 | other | Li8Zn4Si4 | 16 | 164 | 252.63 |
mp-754466 | 9.514054 | 0.729131 | 0.871251 | other | Li2Ag1F3 | 6 | 164 | 63.56 |
mp-3048 | 1.722412 | 1.543752 | 2.522936 | other | U2Se1N2 | 5 | 164 | 89.61 |
mp-1219371 | -5.427896 | -5.969081 | 0.44257 | other | Sm3Mg21Sb16 | 40 | 164 | 1,095.19 |
mp-1216891 | -5.293099 | -3.329024 | 5.148633 | other | U4Si6Ru2 | 12 | 164 | 220.32 |
mp-1025312 | -4.178823 | -0.387919 | -4.065944 | other | Mn1Nb2S4 | 7 | 164 | 129 |
mp-1237425 | -7.300854 | -5.283426 | 3.213684 | other | Tb7Co6Sn23 | 36 | 164 | 969.23 |
mp-1227171 | -7.120421 | -6.618389 | 3.638478 | other | Ce2Ag2Pb2 | 6 | 164 | 233.13 |
mp-1018656 | 3.022041 | -0.524608 | -2.268131 | other | Ca2H3Br1 | 6 | 164 | 90.41 |
mp-1019269 | 2.929738 | -0.252582 | -2.442567 | other | Sr2H3I1 | 6 | 164 | 119.77 |
mp-19774 | -5.638881 | -5.844586 | 0.680579 | other | Eu1Cd2Sb2 | 5 | 164 | 150.16 |
mp-28487 | -5.694637 | -3.350233 | -1.977489 | other | Ge5Te8As2 | 15 | 164 | 416.05 |
mp-1221668 | -6.463112 | -3.153312 | 0.679938 | other | Mn1Cr1Sb2 | 4 | 164 | 80.65 |
mp-1221401 | 12.050627 | 11.227767 | -1.617412 | other | Na2W3O9 | 14 | 164 | 182.1 |
mp-1221931 | 16.015591 | 9.521874 | 5.718943 | other | Mg1Zn2O3 | 6 | 164 | 60.14 |
mp-20519 | -4.108692 | -1.581526 | -5.806572 | other | Cd1In1S2 | 4 | 164 | 88.31 |
mp-7067 | -4.943868 | -5.232985 | 0.448122 | other | Ca1Cd2As2 | 5 | 164 | 121.58 |
mp-1245917 | 1.623512 | 1.762404 | 1.292723 | other | Sr2Ca1N2 | 5 | 164 | 119.27 |
mp-1196839 | -7.237259 | -5.324301 | 3.216123 | other | Y7Co6Sn23 | 36 | 164 | 966.54 |
mp-1206637 | -5.446863 | -1.60561 | -3.448862 | other | Li1V1Se2 | 4 | 164 | 69.87 |
mp-758464 | 10.272917 | 0.4287 | -0.043807 | other | Li2Mn1F6 | 9 | 164 | 138.65 |
mp-7769 | 2.177265 | 1.913948 | 1.670426 | other | Th2S1N2 | 5 | 164 | 97.22 |
mp-23879 | 10.871371 | 4.2283 | -3.638927 | other | Ca1H2O2 | 5 | 164 | 53.49 |
mp-1229248 | -5.799717 | -6.976849 | 3.612766 | other | Ca65Ga24Sn19 | 108 | 164 | 3,218.4 |
mp-1246511 | 0.638528 | 2.27742 | 1.889442 | other | Sr1Co2N2 | 5 | 164 | 60.01 |
mp-1069558 | 1.880152 | 1.57838 | 1.374964 | other | Ce2Se1N2 | 5 | 164 | 93.33 |
mp-755297 | 9.465672 | 12.78432 | 0.011002 | other | Li2Co1O2 | 5 | 164 | 44.12 |
mp-29415 | 1.00709 | 1.951556 | -5.410496 | other | Cd6P2Cl6 | 14 | 164 | 367.48 |
mp-1224378 | -5.538063 | -3.669927 | -2.071023 | other | Ge1Sb4Te4 | 9 | 164 | 282.55 |
mp-1541714 | 1.618904 | 2.672922 | -5.709408 | other | Cs3As2Cl9 | 14 | 164 | 434.59 |
mp-31516 | 9.992129 | 10.356154 | -3.457211 | other | Co2Re4O16 | 22 | 164 | 353.01 |
mp-1018637 | -4.458766 | -1.494973 | -5.745084 | other | Tb1Cu2S2 | 5 | 164 | 86.27 |
mp-29394 | 0.443263 | 0.964404 | -3.387896 | other | Gd2C1Cl2 | 5 | 164 | 115.83 |
mp-4226 | -5.365889 | -0.242209 | -5.761306 | other | Li1Cr1S2 | 4 | 164 | 63.14 |
mp-1247409 | 0.599549 | 2.49559 | 1.734837 | other | Co2Pb1N2 | 5 | 164 | 65.25 |
mp-7429 | -5.490565 | -5.702144 | 0.53561 | other | Ca1Zn2Sb2 | 5 | 164 | 127.98 |
mp-13946 | 8.350291 | 1.118309 | 1.37582 | other | Rb2Zr1F6 | 9 | 164 | 154.01 |
mp-1018766 | -5.160417 | -4.795549 | 0.649123 | other | Li3La1As2 | 6 | 164 | 115.1 |
mp-1028663 | -6.541233 | 2.296051 | -5.66096 | other | W4Se4S4 | 12 | 164 | 338.38 |
mp-1206650 | -5.951461 | -3.485847 | -1.774858 | other | Er1Cu1Te2 | 4 | 164 | 102.94 |
mp-1217770 | -4.074356 | -0.11208 | -3.670078 | other | Ta2Ag1S4 | 7 | 164 | 138.68 |
mp-1216054 | -2.817198 | -3.668172 | -4.163501 | other | Y3Ge1S2 | 6 | 164 | 137.04 |
mp-863260 | -4.925644 | -5.23793 | 0.347468 | other | Sr1Mg2As2 | 5 | 164 | 125.26 |
mp-1220723 | -3.903893 | -4.191057 | -3.669029 | other | Na1La2Se3 | 6 | 164 | 170.44 |
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