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-1104758 | 4.586628 | 2.679429 | -3.514592 | other | Zn1Hg1C4Se4N4 | 14 | 82 | 325.74 |
mp-541914 | 4.641973 | 2.589003 | -3.605452 | other | Mn1Hg1C4S4N4 | 14 | 82 | 300.24 |
mp-1192436 | 10.280356 | 7.234019 | -1.832204 | other | Na5Eu4Si4O16F1 | 30 | 82 | 378.92 |
mp-760729 | 12.629881 | 5.809497 | -1.553833 | other | Ca4Ga4Si2H4O16 | 30 | 82 | 368.92 |
mp-622618 | 7.776521 | 10.82684 | 1.323625 | other | Ba1La1Ni1Ru1O6 | 10 | 82 | 128.74 |
mp-1190520 | 5.800716 | 3.148659 | -3.62127 | other | Cd1Ge4C8S10N2 | 25 | 82 | 580.16 |
mp-542943 | 4.592304 | 2.765808 | -3.544876 | other | Cd1Hg1C4Se4N4 | 14 | 82 | 341.11 |
mp-1192403 | 12.252286 | 6.457043 | 0.177643 | other | Na5Ho4Si4O16F1 | 30 | 82 | 354.94 |
mp-1199516 | 10.196393 | 4.360081 | -6.086469 | other | Na36H16S16Br4O80 | 152 | 85 | 1,967.02 |
mp-560246 | 11.408315 | 4.498029 | -4.665226 | other | Li2U2P2H16O20 | 42 | 85 | 427.3 |
mp-510226 | 11.190082 | 4.754336 | -4.62793 | other | U4Cu2As4H32O40 | 82 | 85 | 908.14 |
mp-1191142 | 11.382993 | 3.969918 | -3.698197 | other | Cu2B2H8Cl2O8 | 22 | 85 | 221.19 |
mp-863300 | 9.25188 | 10.150902 | -3.381584 | other | Na4V2Si2W24O108 | 140 | 85 | 2,336.37 |
mp-560773 | 9.621002 | 4.82856 | -6.281748 | other | K8Na4S8Cl4O24 | 48 | 85 | 861.03 |
mp-1193717 | 8.212953 | 2.710088 | -1.228047 | other | Ti2Cu2N2O8F14 | 28 | 85 | 368.61 |
mp-1180608 | 11.328197 | 4.737648 | -4.587695 | other | Li2U2As2H16O20 | 42 | 85 | 481.82 |
mp-1197655 | 8.525155 | 6.830407 | -5.188223 | other | K10U8V2S8O66 | 94 | 85 | 1,634.1 |
mp-699483 | 11.241801 | 4.528111 | -4.71389 | other | U4Cu2P4H32O40 | 82 | 85 | 873.18 |
mp-1195054 | 8.941592 | 3.372424 | -5.402501 | other | Na8Cu8H36C16O46 | 114 | 86 | 1,310.72 |
mp-699464 | 12.723405 | 6.081441 | -1.018924 | other | Ca12Be8Si12H8O48 | 88 | 86 | 976.03 |
mp-1202772 | 6.878392 | 3.941768 | -5.133718 | other | K4Ru8C16Cl8O32 | 68 | 86 | 1,417.91 |
mp-1197093 | 13.858148 | 6.51961 | -5.843517 | other | K8Ga16P16O64F2 | 106 | 86 | 1,607.36 |
mp-1198675 | 6.864624 | 3.409822 | -5.002746 | other | Cs4Ru8C32Cl8O32 | 84 | 86 | 1,664.77 |
mp-1182769 | 7.403879 | 1.856082 | -4.149599 | other | H48Pd4C8N24Cl16 | 100 | 86 | 1,891.57 |
mp-680235 | 8.199832 | 2.224098 | -0.956047 | other | Cs4Sb4Te24O24F120 | 176 | 86 | 3,196.72 |
mp-1198297 | 8.023809 | 1.580938 | -4.399488 | other | H48Pd4C8N24Cl16 | 100 | 86 | 1,328.19 |
mp-557398 | 11.513346 | 8.069122 | -2.707067 | other | Ca8Fe8Sb8As16O56 | 96 | 88 | 1,476.9 |
mp-1204556 | 7.545475 | 0.428984 | -4.13026 | other | Na4Mg2B8H40N8 | 62 | 88 | 588.9 |
mp-1177608 | 13.277634 | 8.378566 | -7.819893 | other | Li12Mn4V4P12O48 | 80 | 88 | 824.95 |
mp-1045731 | 11.413043 | 8.087822 | -2.994858 | other | Ca8Sb8As16Se8O56 | 96 | 88 | 1,605.74 |
mp-707021 | 9.529445 | 4.733762 | -6.574691 | other | Na24H8Pd4S16O56 | 108 | 88 | 1,523.82 |
mp-1197326 | 8.990026 | 3.404923 | -5.689609 | other | K2Lu2H16C8O24 | 52 | 88 | 588.54 |
mp-1045705 | 11.243893 | 8.033296 | -3.2257 | other | Zn8Sb8As16Se8O56 | 96 | 88 | 1,704.64 |
mp-1198865 | 8.368334 | 2.010174 | -4.67327 | other | Yb2H24C16N2O16 | 60 | 88 | 702.96 |
mp-1045681 | 11.380776 | 8.004078 | -3.169668 | other | Mg8Sb8As16Se8O56 | 96 | 88 | 1,645.49 |
mp-1198950 | 9.043837 | 3.514575 | -5.66656 | other | K2In2H16C8O24 | 52 | 88 | 572.82 |
mp-17019 | 11.111057 | 11.323087 | -2.639431 | other | Ca4Y2As2W4O24 | 36 | 88 | 469.1 |
mp-1200380 | 7.892201 | 3.126935 | -5.301228 | other | Mn8H8C32N24O40 | 112 | 88 | 1,292.01 |
mp-643941 | 12.483537 | 5.403802 | -2.200357 | other | Ca2Al4Si2H8O16 | 32 | 88 | 293.94 |
mp-1228149 | 10.442732 | 8.178514 | 2.108339 | other | Ba3Sr9Al4O16F4 | 36 | 89 | 545.72 |
mp-1227818 | 10.521199 | 8.160334 | 2.098867 | other | Ba1Sr11Al4O16F4 | 36 | 89 | 534.3 |
mp-555698 | 7.895061 | 2.285489 | -1.966088 | other | Fe1B2C6O6F8 | 23 | 87 | 325.39 |
mp-1218927 | 9.389435 | 11.42114 | 0.510298 | other | Sr10Cu5Mo1W4O30 | 50 | 87 | 646.04 |
mp-698210 | 7.865254 | 1.228685 | -4.364547 | other | Rb1Co1H24C14N8 | 48 | 87 | 493.67 |
mp-680165 | 6.984477 | 9.068628 | -0.316521 | other | Ba17Yb16Zn8Pt4O57 | 102 | 87 | 1,518.32 |
mp-560146 | 9.035139 | 8.854256 | 2.474705 | other | Ba17Y16Zn8Pt4O57 | 102 | 87 | 1,551.25 |
mp-555356 | 8.673164 | 9.22715 | 2.086043 | other | Ba13Dy8Zn4Pt4O37 | 66 | 87 | 1,034.49 |
mp-1229188 | 4.637616 | 4.451885 | -3.3804 | other | Al1C2Br5N2O6 | 16 | 87 | 260.69 |
mp-557741 | 9.147491 | 8.789294 | 2.611903 | other | Ba17Tm16Zn8Pt4O57 | 102 | 87 | 1,509.97 |
mp-1196709 | 5.221077 | 3.940917 | -4.316259 | other | Mn4Nb2C16N16O16 | 54 | 87 | 881.42 |
mp-1218934 | 9.638292 | 11.376081 | 0.655278 | other | Sr10Fe4Co1Mo5O30 | 50 | 87 | 633.67 |
mp-1218919 | 7.158431 | 11.12355 | 1.352781 | other | Sr10Ca1Y4Co10O30 | 55 | 87 | 728.46 |
mp-17240 | 12.423339 | 7.263567 | -0.780928 | other | Rb1Na3Li12Si4O16 | 36 | 87 | 383.51 |
mp-561249 | 9.169163 | 8.754682 | 2.618413 | other | Ba17Er16Zn8Pt4O57 | 102 | 87 | 1,522.17 |
mp-744025 | 8.873875 | 11.401555 | 0.973019 | other | Sr8Mg3Fe1Mo4O24 | 40 | 87 | 511.69 |
mp-23983 | 11.584506 | 5.538573 | -5.156388 | other | V2Ni1P2H8O14 | 27 | 87 | 269.01 |
mp-774749 | 10.136862 | 11.749884 | 0.798892 | other | Rb1Na3Li12Ti4O16 | 36 | 87 | 405.08 |
mp-1204055 | 11.734334 | 5.714411 | -5.484803 | other | P8H8Pt2I2O20 | 40 | 87 | 766.42 |
mp-1195951 | 12.976609 | 6.252442 | -0.452675 | other | Rb4Sc2Si8O20F2 | 36 | 87 | 552.14 |
mp-1194573 | 7.856999 | 1.152491 | -4.351905 | other | K1Fe1H24C14N8 | 48 | 87 | 555.42 |
mp-698214 | 7.877585 | 1.160763 | -4.365383 | other | K1Mn1H24C14N8 | 48 | 87 | 498.82 |
mp-1221778 | 11.925523 | 5.609619 | -5.234541 | other | Mn1V2P2H8O14 | 27 | 87 | 275.66 |
mp-1218897 | 8.795513 | 11.377089 | 0.976634 | other | Sr10Mg4Fe1Mo5O30 | 50 | 87 | 640.37 |
mp-1211951 | -6.804114 | 1.353902 | -4.544561 | other | K6Mo6C6Se8N4 | 30 | 87 | 662.53 |
mp-1203070 | 7.64292 | 5.699538 | -4.947865 | other | Na4Cu3S8N5O12 | 32 | 87 | 557.09 |
mp-24174 | 11.668535 | 5.555271 | -5.176507 | other | V2Co1P2H8O14 | 27 | 87 | 271.47 |
mp-556377 | 9.058535 | 8.770804 | 2.467002 | other | Ba17Dy16Zn8Pt4O57 | 102 | 87 | 1,545.1 |
mp-557777 | 13.007599 | 6.209609 | -0.516213 | other | K4Sc2Si8O20F2 | 36 | 87 | 531.25 |
mp-1209084 | 7.835504 | 6.694546 | -4.283666 | other | Sb2P2N4O8F2 | 18 | 87 | 352.79 |
mp-555188 | 9.090608 | 8.73573 | 2.524352 | other | Ba17Ho16Zn8Pt4O57 | 102 | 87 | 1,533.39 |
mp-17125 | 11.990539 | 7.786772 | -1.066469 | other | Cs1Na3Li12Ge4O16 | 36 | 87 | 421.25 |
mp-698446 | 8.463473 | 0.990808 | -4.319185 | other | H24Pt1C8N2F6 | 41 | 87 | 388.99 |
mp-1522023 | 5.98559 | 8.686144 | -0.297065 | other | Sr2Ca2Eu2Bi2O12 | 20 | 90 | 311.06 |
mp-559899 | 12.318116 | 7.824301 | -7.003058 | other | Ba2V2Cu8P8O34 | 54 | 90 | 696.2 |
mp-1520763 | 10.203571 | 11.037435 | 1.072379 | other | Ba2Sr2Eu2W2O12 | 20 | 90 | 317.83 |
mp-1517195 | 9.361698 | 9.141637 | 2.18332 | other | Sr2Ca2Pr2Sb2O12 | 20 | 90 | 301.99 |
mp-1195143 | 12.222037 | 7.176803 | -6.898649 | other | Ba2Ti2Cu8P8O34 | 54 | 90 | 683.94 |
mp-1200866 | 12.901164 | 5.88885 | -1.430156 | other | Na4Ti2Si8H8O26 | 48 | 90 | 599.84 |
mp-1520608 | 11.240973 | 10.388485 | 1.178346 | other | Ba2Sr2Sm2W2O12 | 20 | 90 | 309.67 |
mp-1523151 | 5.913724 | 8.503757 | -0.131093 | other | Sr2Ca2Sm2Bi2O12 | 20 | 90 | 312.32 |
mp-1195138 | 12.183496 | 7.192111 | -6.91334 | other | Sr2Ti2Cu8P8O34 | 54 | 90 | 662.62 |
mp-1519952 | 10.066523 | 9.623941 | 3.515283 | other | Sr2La2Eu2Nb2O12 | 20 | 90 | 311.79 |
mp-39684 | 10.036322 | 10.316093 | 1.606337 | other | Gd4Ti4Cd4Sb4O28 | 44 | 91 | 557.41 |
mp-677151 | 7.704044 | 9.468028 | -1.020801 | other | Yb4Ti4Cd4Sb4O28 | 44 | 91 | 551.03 |
mp-39419 | 10.046868 | 10.31666 | 1.744785 | other | Nd4Ti4Cd4Sb4O28 | 44 | 91 | 567.64 |
mp-645301 | 12.69249 | 8.168653 | -6.621628 | other | K8Co4P8W4O40 | 64 | 92 | 948.83 |
mp-1200466 | 8.293599 | 1.801671 | -0.91011 | other | Rb8Sb8S4O20F24 | 64 | 92 | 1,150.11 |
mp-1199641 | 10.485677 | 12.021111 | -3.634752 | other | Cs16V16Cu8Cl16O48 | 104 | 92 | 2,429.28 |
mp-1213742 | 8.294918 | 1.738137 | -0.658667 | other | Cs8Sb8S4O20F24 | 64 | 92 | 1,252.28 |
mp-560045 | 7.992137 | 1.56794 | -4.41282 | other | H40C8S8N16Cl8 | 80 | 92 | 1,094.15 |
mp-1202739 | 7.844592 | 1.029651 | -4.483527 | other | H24C8S4Br8N8 | 52 | 92 | 835.64 |
mp-744713 | 11.022177 | 5.377065 | -5.357047 | other | Na4Fe12P8H32O56 | 112 | 92 | 1,081.26 |
mp-556502 | 12.39465 | 7.983561 | -6.593015 | other | K8Ni4P8W4O40 | 64 | 92 | 937.39 |
mp-1195064 | 9.200476 | 1.646592 | -4.13777 | other | Sn8H88S24N16O12 | 148 | 92 | 1,810.51 |
mp-1194589 | 8.947829 | 2.443144 | -4.659513 | other | Ge4H24C8S8O24 | 68 | 92 | 853.19 |
mp-1209560 | 8.023301 | 2.742414 | -1.641569 | other | Sb8S4N8O20F24 | 64 | 92 | 1,081.15 |
mp-764968 | 11.265462 | 3.640023 | -4.809316 | other | In8P8H40N8O40 | 104 | 96 | 1,027.77 |
mp-1199747 | 7.791498 | 0.595078 | -4.051281 | other | Li8Mg4B16H136N24 | 188 | 96 | 1,642.4 |
mp-733729 | 12.784293 | 5.414185 | -6.334871 | other | Rb8In8P8H8O40 | 72 | 96 | 1,035.88 |
mp-767240 | 9.818984 | 2.501655 | -4.392197 | other | Cs4P4H16N8O8 | 40 | 96 | 503.01 |
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