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-698293 | 8.901271 | 2.73675 | -5.047245 | other | V2P2H12C4N6O14 | 40 | 2 | 416.5 |
mp-1223295 | 9.049375 | 1.843382 | -0.008364 | other | Li2Mg1Zr2H4O4F12 | 25 | 2 | 309.78 |
mp-1183871 | 12.500194 | 6.038561 | -6.139392 | other | Co2B2P4H2Pb2O18 | 30 | 2 | 347.59 |
mp-760236 | 14.356177 | 8.512345 | -7.208579 | other | Li6V3Cr3P6O24F6 | 48 | 2 | 541.94 |
mp-1205165 | 8.255572 | 5.336469 | -4.193938 | other | Na2Zn8H12S2Cl2O32 | 58 | 2 | 773.46 |
mp-1248208 | 13.049027 | 6.590342 | -0.94532 | other | Na6Ca6Zr4Si8O30F6 | 60 | 2 | 890.9 |
mp-849539 | 13.227051 | 7.801804 | -7.260574 | other | Li4Mn2V2P4H4O20 | 36 | 2 | 370.57 |
mp-1201788 | 8.734569 | 3.435492 | -6.085104 | other | Na2U2Co1H8C12O28 | 53 | 2 | 602.48 |
mp-1263007 | 12.224182 | 5.455095 | -2.755059 | other | Ca4Mn2Fe2Si8H10O30 | 56 | 2 | 687.86 |
mp-764581 | 13.623266 | 8.55228 | -7.581844 | other | Li6V3Fe3P6O24F6 | 48 | 2 | 547.99 |
mp-729907 | 8.370564 | 1.210211 | -4.49213 | other | Ni1H48C16S8N2O14 | 89 | 2 | 992.26 |
mp-1233018 | 13.040265 | 7.798949 | -7.243178 | other | Mg1Mn1V1P2H2O10 | 17 | 2 | 182.71 |
mp-1204279 | 7.749955 | 0.168136 | -4.512864 | other | Si16Te8H176Pd8C64Cl16 | 288 | 2 | 4,057.36 |
mp-1234851 | 10.325629 | 1.838151 | -1.244832 | other | Mg1Al2H4Pb2O4F6 | 19 | 2 | 251.8 |
mp-697077 | 8.662263 | 2.349892 | -1.999315 | other | As2H6C2N2O2F18 | 32 | 2 | 385.66 |
mp-776446 | 13.655563 | 8.5206 | -7.943015 | other | Li6Mn3V3P6O24F6 | 48 | 2 | 550.89 |
mp-772727 | 9.58826 | 3.589337 | -8.692137 | other | Na2Li10Mn4P4C4O28 | 52 | 2 | 578.02 |
mp-776506 | 13.218819 | 7.79844 | -7.285433 | other | Li6Mn3V3P6H6O30 | 54 | 2 | 554.53 |
mp-1204548 | 12.051245 | 4.945277 | -5.053468 | other | Ca8Al4P4H20O26F16 | 78 | 2 | 827.17 |
mp-1201380 | 9.41535 | 3.333545 | -4.010687 | other | V1H17C4S4O20F12 | 58 | 2 | 737.75 |
mp-554977 | 8.825644 | 1.346392 | -4.412159 | other | B4H20C4N2Cl2O6 | 38 | 2 | 396.92 |
mp-603946 | 8.702033 | 1.966717 | -4.447048 | other | Ag2Mo8H44C16N6O30 | 106 | 2 | 1,126.31 |
mp-1197228 | 10.80336 | 3.511186 | -4.541523 | other | Ni2P8H36C4N4O30 | 84 | 2 | 788.96 |
mp-764571 | 13.618981 | 8.553432 | -7.579572 | other | Li4V2Fe2P4O16F4 | 32 | 2 | 367.42 |
mp-1195110 | 8.600245 | 1.950793 | -4.587152 | other | Na2Fe2H44C20N4O24 | 96 | 2 | 1,007.65 |
mp-23809 | 13.166371 | 5.171995 | -6.058275 | other | Rb2Sc2B2P4H2O18 | 30 | 2 | 370.58 |
mp-1233873 | 12.825952 | 7.568956 | -6.184443 | other | K2Mg1Fe4P6O16F12 | 41 | 2 | 587.3 |
mp-1212031 | 10.819717 | 4.196685 | -7.224253 | other | K2Ca2Mg1H2S4O16 | 27 | 2 | 365.42 |
mp-1197622 | 10.943578 | 3.778727 | -4.86665 | other | Na4Tl2P6H14N6O16 | 48 | 2 | 550.08 |
mp-849542 | 13.231289 | 7.805974 | -7.261159 | other | Li4Mn2V2P4H4O20 | 36 | 2 | 371.46 |
mp-744242 | 9.623457 | 4.875524 | -4.200827 | other | Na4Te1Mo6H40N2O40 | 93 | 2 | 1,116.42 |
mp-541794 | 12.274289 | 6.262364 | -6.663728 | other | K2Fe2B2P4H2O18 | 30 | 2 | 344.2 |
mp-1199767 | 7.762931 | 1.500782 | -4.338138 | other | Mg1B2H42C26N14O6 | 91 | 2 | 1,170.96 |
mp-1196797 | 6.012554 | 3.503512 | -3.897217 | other | Ag2As2S32N32O16F12 | 96 | 2 | 1,731.17 |
mp-24827 | 13.877796 | 6.986039 | -6.037883 | other | K4V4B4P8H4O36 | 60 | 2 | 720.63 |
mp-1200478 | 8.681083 | 2.097493 | -4.583984 | other | As2H18C4S2N8O8 | 42 | 2 | 474.72 |
mp-693605 | 13.295076 | 7.115871 | -0.853611 | other | Na6Mg8Cr2Si16O44F4 | 80 | 2 | 957.01 |
mp-1214713 | 12.788415 | 6.606812 | -2.06851 | other | Ba4Ti2Mn4Si4P2O26 | 42 | 2 | 580.75 |
mp-1227427 | 12.390624 | 5.044254 | -5.453347 | other | Ca6Mg2Zn1P6H12O30 | 57 | 2 | 577.6 |
mp-624009 | 5.884572 | 3.417287 | -4.607669 | other | Fe4Te2W2C20Se2O20 | 50 | 2 | 900.7 |
mp-697033 | 8.425539 | 1.83504 | -4.537896 | other | Cd2H8C2N4Cl4O2 | 22 | 2 | 310.01 |
mp-1204215 | 9.490998 | 2.830816 | -4.684549 | other | Cd1H20C2S2N6O12 | 43 | 2 | 403 |
mp-2229247 | 8.06239 | 3.508349 | -3.525236 | other | Mg1Cu1C2S2O6F6 | 18 | 2 | 283.17 |
mp-1204315 | 8.782471 | 2.618434 | -4.881268 | other | U2H20C8S2N6O18 | 56 | 2 | 668.82 |
mp-557379 | 7.983589 | 1.268845 | -4.582202 | other | P8H24C16N8Cl8O4 | 68 | 2 | 961.52 |
mp-766092 | 13.252415 | 8.66221 | -7.705286 | other | Li2V2Cr2P4O16F4 | 30 | 2 | 354.9 |
mp-759864 | 12.759518 | 7.798646 | -7.133485 | other | Li2V2Cr2P4H4O20 | 34 | 2 | 356.58 |
mp-698396 | 7.075296 | 2.090533 | -4.294112 | other | Cu2H8C4N2Cl6O2 | 24 | 2 | 385.21 |
mp-1218823 | 7.90936 | 9.818727 | 1.497629 | other | Sr8Ca1Y3Cu12Pb8O32 | 64 | 2 | 940.12 |
mp-1193721 | 7.859486 | 1.357278 | -4.47322 | other | Fe1H12C8S2N2O2 | 27 | 2 | 362.49 |
mp-1234960 | 13.989246 | 6.98561 | -5.110151 | other | Sr2Mg1Zn2Sn2P4O16 | 27 | 2 | 401.85 |
mp-567146 | 7.884505 | 0.308368 | -4.469188 | other | Si6P2H54C18Br2N4 | 86 | 2 | 981.99 |
mp-1197081 | 13.687476 | 6.218472 | -1.627901 | other | Na2Mn4Si6B2H4O22 | 40 | 2 | 441.43 |
mp-1203137 | 8.033622 | 0.488565 | -4.418527 | other | Sn4As4H48C16S4O6 | 82 | 2 | 1,136.13 |
mp-559063 | 7.975632 | 2.795069 | -2.419978 | other | Cs2B2C6N2O4F18 | 34 | 2 | 507.58 |
mp-754810 | 13.263556 | 7.821021 | -7.239748 | other | Li2Mn1V1P2H2O10 | 18 | 2 | 182.78 |
mp-1201982 | 9.029668 | 3.669519 | -5.892558 | other | K4U2H12C8Se2O30 | 58 | 2 | 830.96 |
mp-1222184 | 13.015345 | 6.450045 | -0.548855 | other | Mg2Al12Fe2Si4B4O36 | 60 | 26 | 679.92 |
mp-1208085 | 10.95679 | 8.442805 | -6.474519 | other | V2Co4P4H6N2O18 | 36 | 26 | 475.33 |
mp-695670 | 12.837128 | 6.551156 | -0.763773 | other | Na2Ca6Mg2Fe2Si8O28 | 48 | 28 | 684.83 |
mp-1205234 | 8.538806 | 2.053333 | -4.416368 | other | Ag8H64C24S16Cl8O32 | 152 | 29 | 1,902.51 |
mp-1180681 | 5.626048 | 3.339969 | -3.575494 | other | Os4C32I16N12O4F4 | 72 | 29 | 1,935.85 |
mp-1179444 | 3.651882 | 3.170392 | -3.976697 | other | Re4C4S4N8Cl12O8 | 40 | 29 | 1,208.27 |
mp-1204366 | 3.929395 | 3.037784 | -3.887365 | other | Re4C4S4N8Cl12O8 | 40 | 29 | 1,167.81 |
mp-559423 | 8.313113 | 1.620706 | -4.461396 | other | Ag4H32C20S8O8F12 | 84 | 29 | 1,078.13 |
mp-605676 | 8.254713 | 1.879377 | -4.280619 | other | Ag4H32C28S8O8F28 | 108 | 29 | 1,345.11 |
mp-600211 | 8.578906 | 1.22376 | -4.322672 | other | Mo8H104C32N8O20F24 | 196 | 29 | 1,882.92 |
mp-774708 | 8.534627 | 2.090348 | -4.582116 | other | Zn4H48C12S16N24O16 | 120 | 29 | 1,355.36 |
mp-1204242 | 9.856174 | 3.086773 | -4.846342 | other | Np4P8H36C8N4O44 | 104 | 29 | 1,160.44 |
mp-1202069 | 8.927629 | 7.804075 | -4.797883 | other | Fe8P8N8Cl8O24F12 | 68 | 29 | 1,150.83 |
mp-1201038 | 12.878335 | 6.191956 | -0.883958 | other | K4Na4Al24Si24H16O96 | 168 | 3 | 1,863.25 |
mp-1173823 | 13.423923 | 7.081274 | -0.736717 | other | Na4Ca4Al4Fe4Si16O48 | 80 | 3 | 886.66 |
mp-1199440 | 9.273289 | 3.378437 | -4.688796 | other | U4H24C4Se6N12O32 | 82 | 3 | 1,050.22 |
mp-1221120 | 12.738024 | 6.446745 | -0.588736 | other | Na1Ca3Sc1Zn3Si8O24 | 40 | 3 | 463.82 |
mp-1221133 | 13.638346 | 7.350974 | -0.821471 | other | Na1Ca3Al1Fe3Si8O24 | 40 | 3 | 454.3 |
mp-1234758 | 10.104685 | 3.131124 | -3.91052 | other | Cs4Mg1Mn4H16Cl12O8 | 45 | 3 | 865.56 |
mp-2226471 | 11.721954 | 11.830076 | -2.602393 | other | Cs2Mg1Mn1V2Cl2O6 | 14 | 3 | 305.76 |
mp-1221259 | 12.967182 | 6.839723 | -0.960614 | other | Na3Ca1Mg1Cr3Si8O24 | 40 | 3 | 441.24 |
mp-1221261 | 12.945532 | 6.445141 | -0.398765 | other | Na3Ca1Sc3Zn1Si8O24 | 40 | 3 | 468.12 |
mp-1197973 | 12.878613 | 6.195189 | -0.890932 | other | K2Na2Al12Si12H8O48 | 84 | 3 | 928.75 |
mp-1221119 | 12.607595 | 6.712451 | -0.752381 | other | Na1Ca3Mg3Fe1Si8O24 | 40 | 3 | 452.12 |
mp-1223597 | 12.783963 | 6.543276 | -0.521165 | other | K1Ca3Mg3Al1Si8O24 | 40 | 3 | 452.25 |
mp-1228946 | 11.076653 | 11.980636 | -3.5564 | other | Ba10Mg1Mn3V8Cl12O28 | 62 | 3 | 1,164.89 |
mp-1229204 | -0.968219 | 1.1457 | -5.113304 | other | Ag8Hg10S10I2Br2Cl4 | 36 | 3 | 969.43 |
mp-1226437 | 8.656026 | 10.151008 | -3.31245 | other | Cr4H4Pb8Cl2O20F2 | 40 | 31 | 646.07 |
mp-759846 | 14.405517 | 7.623015 | -6.484274 | other | Li12Mn4Fe4Co4P12O48 | 84 | 31 | 910.85 |
mp-1200842 | 8.043529 | 1.648297 | -4.433973 | other | Cd2H16C4S4N8Cl4 | 38 | 31 | 587.23 |
mp-1223420 | 2.754941 | 2.380552 | 1.604001 | other | Li28Nd10Si22N38O14F4 | 116 | 31 | 1,336.7 |
mp-1202476 | 10.167812 | 4.309426 | -5.767788 | other | Cu4H12Pb10C2S6O42 | 76 | 31 | 986.96 |
mp-1224471 | 2.643043 | 2.397071 | 1.781441 | other | Li28Ce10Si22N38O14F4 | 116 | 31 | 1,340.06 |
mp-699265 | 7.751369 | 5.229112 | -5.17981 | other | B2H12Ru6C12O38F8 | 78 | 31 | 1,108.66 |
mp-1199928 | 8.769877 | 2.040278 | -4.518844 | other | Na4H24C4N8Cl4O8 | 52 | 31 | 613.34 |
mp-690844 | 4.03188 | 3.082057 | -3.942883 | other | Fe2H4C8N8Cl12O2 | 36 | 32 | 835.78 |
mp-698033 | 12.021056 | 4.704953 | -5.027632 | other | K2Al4P4H16O24F2 | 52 | 32 | 520.25 |
mp-558968 | 7.417988 | 2.739536 | -3.100341 | other | Mn8P8C48S4O32F48 | 148 | 33 | 2,396.25 |
mp-1198652 | 8.073772 | 1.078923 | -4.487061 | other | Te4H72C36S24N12Cl4 | 152 | 33 | 2,160.04 |
mp-759615 | 14.600022 | 7.603216 | -5.70987 | other | Na8Li4Ca4V4P8O36 | 64 | 33 | 778.52 |
mp-541423 | 11.27785 | 3.989664 | -4.865458 | other | Fe8P8H32N8O32F8 | 96 | 33 | 926.12 |
mp-1207595 | 9.25149 | 2.390697 | -4.681865 | other | Zn4P8H52C8N24O32 | 128 | 33 | 1,375.05 |
mp-1211222 | 9.937103 | 7.182483 | -2.157472 | other | Na8Al12Si12H4N4O48 | 88 | 33 | 1,480.53 |
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