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-1200530 | 7.45948 | 1.6725 | -4.260842 | other | Zn4H16C8N16Cl8 | 52 | 29 | 812.35 |
mp-23150 | 5.384545 | 3.396904 | -4.217642 | other | C4S8N4Cl4O8 | 28 | 29 | 640.15 |
mp-555092 | -3.456339 | -1.01156 | -5.350254 | other | K12W4S12Cl4O4 | 36 | 29 | 1,031.23 |
mp-1195726 | 7.584671 | 0.421734 | -4.171811 | other | Na4Li4B8H40N8 | 64 | 29 | 586.59 |
mp-1194832 | 10.36599 | 3.185754 | -5.016006 | other | Li8H32S8N8O32 | 88 | 29 | 847.99 |
mp-780431 | 12.915483 | 5.768404 | -5.533915 | other | Li8Fe8P8H16O40 | 80 | 29 | 878.31 |
mp-1197950 | 7.913384 | 5.953623 | -3.921432 | other | Rb12Mo8H4C4O52 | 80 | 29 | 1,320.73 |
mp-849312 | 11.748607 | 7.589236 | -7.44337 | other | Li4Mn4P12H4O40 | 64 | 29 | 916 |
mp-1198449 | 6.310444 | 3.654413 | -3.653705 | other | Sb4C4N8O4F12 | 32 | 29 | 604.33 |
mp-1099629 | 10.730711 | 11.905668 | -3.17534 | other | K2Na6V5Mo3O24 | 40 | 3 | 465.06 |
mp-1216150 | 12.777483 | 5.638917 | -3.105945 | other | Y1Fe6Bi1B8O24 | 40 | 3 | 413.74 |
mp-697306 | 7.23522 | 11.961092 | 2.00616 | other | K1Sr3La8Mn12O36 | 60 | 3 | 721.15 |
mp-703320 | 11.191637 | 11.006357 | 0.473196 | other | Sr16Fe6Co2Mo8O45 | 77 | 3 | 1,046.86 |
mp-1221254 | 12.00085 | 7.203532 | -1.836284 | other | Na3Li1Fe4Si8O24 | 40 | 3 | 442.93 |
mp-1265310 | 11.873984 | 6.847757 | -1.416432 | other | Na8Al6Ge6N2O30 | 52 | 3 | 791.01 |
mp-1222575 | 12.786338 | 6.419185 | -0.80725 | other | Li4Sc1In3Si8O24 | 40 | 3 | 465.69 |
mp-1233254 | 9.483726 | 6.028279 | -3.983534 | other | Rb4Mg1H12Se8O24 | 49 | 3 | 896.99 |
mp-1173714 | 12.74369 | 6.140548 | -0.645248 | other | Na8Al6Si6N2O28 | 50 | 3 | 730.04 |
mp-1221279 | 12.76719 | 6.497261 | -0.842864 | other | Na3Li1Ga4Si8O24 | 40 | 3 | 432.15 |
mp-1233373 | 9.131639 | 7.373142 | -1.977729 | other | Mg1Tl2Pb16Br18O8 | 45 | 3 | 1,390.61 |
mp-761259 | 14.323305 | 8.517707 | -7.266566 | other | Li12Mn2V6P12O48 | 80 | 3 | 931.82 |
mp-1266279 | 7.929107 | 10.526987 | 1.331779 | other | Ba2Al1Tl1Co2O7 | 13 | 3 | 198.12 |
mp-775186 | 12.562023 | 6.776639 | -0.905532 | other | Li8Sc5Fe3Si16O48 | 80 | 3 | 896.16 |
mp-720111 | 11.888812 | 6.478345 | -1.900196 | other | Na8Al6Si6Cl2O32 | 54 | 3 | 772.77 |
mp-1173868 | 12.988419 | 6.460557 | -0.80402 | other | Na12Mg5Al2Si29O72 | 120 | 3 | 1,261.86 |
mp-1565615 | 13.023215 | 7.0297 | -1.128661 | other | Na2Ca2Fe4Si8O24 | 40 | 3 | 458.14 |
mp-1221157 | 12.98982 | 6.424588 | -0.44055 | other | Na4Sc3In1Si8O24 | 40 | 3 | 474.55 |
mp-1198906 | 10.501062 | 11.072604 | -2.876941 | other | V12Co18Te6Pb18O84 | 138 | 3 | 2,104.76 |
mp-1233262 | 11.976642 | 11.40414 | 2.0648 | other | Mg1Ta4Mn4Nb4O24 | 37 | 3 | 455.52 |
mp-1227614 | 12.709766 | 6.487018 | -0.656587 | other | Ca4Mg3Si8Ni1O24 | 40 | 3 | 456.59 |
mp-1227711 | 12.707088 | 6.87692 | -1.235027 | other | Ca4Co1Si8Ni3O24 | 40 | 3 | 454.46 |
mp-1234341 | 11.964114 | 11.407727 | 2.06479 | other | Mg1Ta4Mn4Nb4O24 | 37 | 3 | 452.02 |
mp-600181 | 8.476086 | 0.865888 | -4.431771 | other | Lu2H48C8N8Cl14 | 80 | 3 | 1,013.63 |
mp-1221226 | 12.651096 | 6.727789 | -0.87436 | other | Na4Al3Fe1Si8O24 | 40 | 3 | 423.59 |
mp-1076264 | 6.103138 | 11.102233 | -0.057025 | other | Ba2Sr6Co3Cu5O24 | 40 | 3 | 484.81 |
mp-667381 | 8.69662 | 3.483511 | -7.11908 | other | Ba12Ce8C20O60F8 | 108 | 3 | 1,571.93 |
mp-1076457 | 5.381149 | 11.163153 | -0.687062 | other | Sr6Ca2Fe5Co3O24 | 40 | 3 | 465.82 |
mp-677474 | 12.039675 | 6.984241 | -1.34398 | other | Na8Al6Ge6N2O30 | 52 | 3 | 789.22 |
mp-1234580 | 9.41358 | 6.214899 | -3.888825 | other | Rb4Mg1H12Se8O24 | 49 | 3 | 886.55 |
mp-1227136 | 13.639541 | 7.393161 | -0.862064 | other | Ca4Zn1Fe3Si8O24 | 40 | 3 | 447.91 |
mp-1220832 | 12.022148 | 7.22685 | -1.838582 | other | Na1Li3Fe4Si8O24 | 40 | 3 | 435.95 |
mp-1076429 | 5.949301 | 11.281157 | -0.060884 | other | Ba2Sr6Co5Cu3O24 | 40 | 3 | 484.38 |
mp-735586 | 9.255948 | 6.971128 | -3.61612 | other | K2Fe4H2Se8O24 | 40 | 3 | 587.4 |
mp-1216022 | 13.825226 | 4.589002 | -1.939202 | other | Y1Er1Al6B8O24 | 40 | 3 | 367.7 |
mp-2231165 | 11.715562 | 10.090548 | -2.249991 | other | Mg1Cd2Te2Mo2O12 | 19 | 3 | 300.01 |
mp-695202 | 12.926268 | 6.338652 | -0.430875 | other | Mg4Al9Cu1Si9O36 | 59 | 3 | 800.89 |
mp-2230560 | 12.08699 | 10.379286 | -1.912947 | other | Mg1Mn2Te2Mo2O12 | 19 | 3 | 286.92 |
mp-761156 | 10.01015 | 11.029134 | 3.240457 | other | Li3La5Ti6Nb2O26 | 42 | 3 | 521.71 |
mp-1094109 | 9.621956 | 12.267338 | -0.30851 | other | Na6Mn1Ni3Sb2O12 | 24 | 3 | 275.31 |
mp-1218286 | 8.208613 | 11.54403 | 2.12518 | other | Sr1La3Mn2Cr2O12 | 20 | 3 | 241.91 |
mp-1199741 | 11.817766 | 6.954467 | -4.382162 | other | Zn18Te6P12Pb18O84 | 138 | 3 | 1,992.18 |
mp-1076805 | 5.484557 | 11.391203 | -0.405491 | other | Sr6Ca2Fe3Co5O24 | 40 | 3 | 462.05 |
mp-1075901 | 5.88774 | 11.461435 | -0.032619 | other | Sr6Ca2Co5Cu3O24 | 40 | 3 | 461.98 |
mp-1248193 | 12.605976 | 6.530527 | -0.677719 | other | Al12Si12Ag16S5O48 | 93 | 3 | 1,446.5 |
mp-1173789 | 12.496885 | 6.250706 | -1.174523 | other | Na8Al6Si6H6O28 | 54 | 3 | 784.05 |
mp-694997 | 8.987346 | 0.918658 | 0.610392 | other | K4Na2Fe1H3F12 | 22 | 3 | 307.92 |
mp-2231384 | 11.669752 | 10.432675 | -2.417703 | other | Mg1Co2Te2Mo2O12 | 19 | 3 | 276.99 |
mp-1221188 | 9.196201 | 7.718454 | -2.563462 | other | Na1Ca3Fe1Si8O24 | 37 | 3 | 476.66 |
mp-1218570 | 12.737371 | 6.508452 | -0.465739 | other | Sr1Ca3Mg4Si8O24 | 40 | 3 | 460.84 |
mp-2230577 | 11.901094 | 10.272153 | -2.171259 | other | Mg1Zn2Te2Mo2O12 | 19 | 3 | 279.34 |
mp-2227666 | 11.848335 | 11.28939 | -3.324096 | other | Mg1Fe2Mo2Cl2O8 | 15 | 3 | 264.68 |
mp-1077670 | 5.658601 | 11.306344 | -0.163242 | other | Sr6Ca2Mn3Fe5O24 | 40 | 3 | 470.77 |
mp-1173263 | 8.339269 | 9.931205 | 1.511877 | other | Sr8Mn4Bi4Pb4O24 | 44 | 3 | 728.7 |
mp-1222629 | 12.273107 | 7.092769 | -1.521678 | other | Li4Sc1Fe3Si8O24 | 40 | 3 | 439.47 |
mp-1077671 | 5.957485 | 11.524627 | 0.354267 | other | Sr6Ca2Mn5Fe3O24 | 40 | 3 | 469.01 |
mp-694964 | 10.889492 | 6.975591 | -1.862888 | other | Na8Mn2Al6Si6O32 | 54 | 3 | 782.57 |
mp-1189847 | -3.388235 | -1.138386 | -5.395831 | other | K6H2W2S8O2 | 20 | 31 | 531.12 |
mp-1189247 | -3.439104 | -1.098498 | -5.219342 | other | K6Mo2H2S8O2 | 20 | 31 | 525.32 |
mp-510292 | 10.993182 | 3.459264 | -4.695119 | other | Cu2P2H12N2O10 | 28 | 31 | 245.04 |
mp-766130 | 14.900189 | 7.776812 | -5.706178 | other | Li8Mn2Fe6P8O32 | 56 | 31 | 609.86 |
mp-1228355 | -3.0641 | -1.414382 | -5.546805 | other | Ba8Sn2Ge4S16Br4 | 34 | 31 | 1,024.77 |
mp-782655 | 11.263711 | 4.119266 | -4.352178 | other | Li2Fe2P2H24O20 | 50 | 31 | 457.01 |
mp-729848 | 10.398297 | 10.889244 | -3.303143 | other | Mo6P2W18N6O80 | 112 | 31 | 2,712.42 |
mp-1228968 | -3.02414 | -1.4682 | -5.58305 | other | Ba8Ge4Pb2S16Br4 | 34 | 31 | 1,028.4 |
mp-831046 | 12.748935 | 5.701925 | -5.667044 | other | Li4Mn4P4H8O20 | 40 | 31 | 454.41 |
mp-761246 | 14.842422 | 7.702294 | -6.119243 | other | Li4Mn2Fe2P4O16 | 28 | 31 | 307.85 |
mp-697560 | 11.158875 | 3.584994 | -4.690939 | other | Co4P4H24N4O20 | 56 | 31 | 487.02 |
mp-756078 | 12.818396 | 5.872224 | -5.434777 | other | Li2Fe2P2H4O10 | 20 | 31 | 210.97 |
mp-755283 | 9.745903 | 3.911127 | -8.33762 | other | Li12Fe4P4C4O28 | 52 | 31 | 575.59 |
mp-1214976 | 12.30566 | 9.996819 | 0.467751 | other | Ba2U6W6Se4O28 | 46 | 31 | 922.64 |
mp-764410 | 10.205689 | 8.305508 | -7.108461 | other | Mn4Fe4Co4P12O48 | 72 | 31 | 861.14 |
mp-1193857 | 6.663232 | 5.206989 | -4.734216 | other | P2H2Pb4N4O18 | 30 | 31 | 438.42 |
mp-780882 | 12.696641 | 5.629449 | -5.660731 | other | Li2Mn2P2H4O10 | 20 | 31 | 229.36 |
mp-1198752 | 8.345802 | 6.176126 | -5.405524 | other | Cu4Pb10C2S6O42 | 64 | 31 | 962.64 |
mp-559463 | 11.099227 | 4.07671 | -4.213765 | other | Rb2Mg2As2H24O20 | 50 | 31 | 510.54 |
mp-1019525 | 13.628247 | 4.447944 | -2.26073 | other | Ba6Zn2B10P2O28 | 48 | 31 | 627.23 |
mp-1209704 | 13.056453 | 6.50925 | -0.34308 | other | Rb4Na4Al6Si6O24 | 44 | 31 | 683.86 |
mp-561299 | -3.117248 | -1.472659 | -5.62063 | other | As4Pb8S12I2Cl2 | 28 | 31 | 778.01 |
mp-850407 | 11.162075 | 4.065288 | -4.392612 | other | Li2Mn2P2H24O20 | 50 | 31 | 467.49 |
mp-1346558 | 8.738092 | 1.444097 | 1.324006 | other | K4Na2Nb2O4F8 | 20 | 31 | 319.45 |
mp-604725 | 11.122433 | 3.95988 | -4.287047 | other | Rb2Mg2P2H24O20 | 50 | 31 | 465.19 |
mp-601268 | 10.72102 | 3.440795 | -4.566724 | other | Fe2P2H10C2O8 | 24 | 31 | 254.47 |
mp-23973 | 12.698796 | 5.558238 | -5.519934 | other | K4Mn4P4H8O20 | 40 | 31 | 481.74 |
mp-1215417 | -4.879747 | -2.012933 | -5.256064 | other | Zn2Cu4Ge2Se4S4 | 16 | 31 | 332.07 |
mp-721617 | 11.127479 | 3.979202 | -4.291188 | other | K2Mg2P2H24O20 | 50 | 31 | 479.51 |
mp-644129 | 12.03446 | 5.38551 | -5.596897 | other | K4Ni4P4H8O20 | 40 | 31 | 447.57 |
mp-735529 | 11.334473 | 3.780677 | -4.672489 | other | Fe2P2H12N2O10 | 28 | 31 | 248.87 |
mp-1228759 | -4.368392 | -3.045943 | -3.718388 | other | Ba8Ge4Pb2Se16Br4 | 34 | 31 | 1,121.69 |
mp-1214018 | 4.56164 | 2.877051 | -3.707755 | other | Cd2C4S4N8Cl4 | 22 | 31 | 508.34 |
mp-721161 | 10.785058 | 3.369703 | -4.309114 | other | Mg2P2H32N2O20 | 58 | 31 | 485.3 |
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