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-1224129 | -4.858665 | -2.840375 | -4.005167 | other | In1Cu1Sn1Se4 | 7 | 82 | 199.86 |
mp-1223893 | -4.729952 | -2.79093 | -3.897038 | other | In1Ag1Ge1Se4 | 7 | 82 | 192.92 |
mp-1223359 | 11.405993 | 11.103663 | -3.915482 | other | K1Sm1Mo2O8 | 12 | 82 | 175.95 |
mp-1227669 | 12.093502 | 7.331702 | 0.31818 | other | Ca4Al6Cr1O16 | 27 | 82 | 408.5 |
mp-724470 | 7.014106 | 6.530281 | -4.049156 | other | Zn1Mo1N4O8 | 14 | 82 | 261.96 |
mp-1224211 | -3.68756 | -1.481063 | -5.578555 | other | K3Ag9Sb4S12 | 28 | 82 | 716.16 |
mp-2226140 | -4.573531 | -0.604872 | -5.441291 | other | Mg1Cu2W1S4 | 8 | 82 | 181.77 |
mp-698325 | 8.669074 | 3.26285 | -5.566864 | other | Ba4H16C12O24 | 56 | 82 | 728.6 |
mp-8873 | 13.331425 | 4.88598 | -2.240446 | other | Li1Ge1B1O4 | 7 | 82 | 72.73 |
mp-628665 | 1.341711 | 2.20777 | -5.260552 | other | Al4Bi4Te4Cl16 | 28 | 82 | 929.02 |
mp-632402 | 8.964317 | 1.682293 | 1.567406 | other | Li1Ca1U1F8 | 11 | 82 | 154.8 |
mp-559185 | 11.270291 | 11.071198 | -3.629192 | other | Li16Bi4Mo14O56 | 90 | 82 | 1,244.2 |
mp-1228950 | -5.269541 | -2.818678 | -4.276986 | other | Al1Ga1Cu2Se4 | 8 | 82 | 178.53 |
mp-1104176 | 11.080964 | 11.010864 | 0.457522 | other | Ba1Ho1Fe4O7 | 13 | 82 | 187.19 |
mp-1223852 | -4.255691 | -1.356573 | -5.916036 | other | In1Ga1Ag2S4 | 8 | 82 | 188.88 |
mp-637206 | 1.38675 | 2.232471 | -5.36824 | other | Al4Bi4Se4Cl16 | 28 | 82 | 857.54 |
mp-39995 | 5.97859 | 10.232795 | -1.249999 | other | Sr1Nb1Fe1O6 | 9 | 82 | 124.33 |
mp-1224876 | -4.76394 | -2.701879 | -3.963271 | other | Ga1Ag1Sn1Se4 | 7 | 82 | 198.99 |
mp-761486 | 14.779449 | 7.732436 | -5.582012 | other | Li4Fe4P4O16 | 28 | 82 | 358.05 |
mp-1223856 | -6.069645 | -3.364154 | -2.308378 | other | In1Ga1Ag2Te4 | 8 | 82 | 266.97 |
mp-2223622 | 14.863007 | 7.002285 | -2.018844 | other | Mg1V1B1O4 | 7 | 82 | 79.47 |
mp-2241251 | 7.339608 | 9.774635 | 0.318125 | other | La2Mg1Cu4O8 | 15 | 82 | 200.96 |
mp-1225065 | -4.719909 | -1.073741 | -5.653006 | other | Fe1Cu2Ge1S4 | 8 | 82 | 149.5 |
mp-2210710 | 13.914161 | 8.328054 | -2.918563 | other | Mg1Fe1P1O4 | 7 | 82 | 94.61 |
mp-866713 | 1.450663 | 2.842867 | -4.482389 | other | Re4Te4S4Cl16 | 28 | 82 | 843.56 |
mp-1025333 | -3.446004 | -0.250585 | -4.903891 | other | Ag1W1S4N1 | 7 | 82 | 193.06 |
mp-2226153 | 1.571018 | 1.993332 | -4.054265 | other | Mg1W1Br4O1 | 7 | 82 | 176.22 |
mp-1224861 | -6.100242 | -3.205721 | -2.27614 | other | Ga2Cu1Ag1Te4 | 8 | 82 | 238.68 |
mp-1209338 | 13.100113 | 6.000596 | -6.271186 | other | Rb2Sr1P4O12 | 19 | 82 | 294.17 |
mp-1227619 | 12.484889 | 6.863639 | 0.468098 | other | Ca4Al6S1O16 | 27 | 82 | 405.76 |
mp-2225329 | 14.34745 | 7.413049 | -4.987742 | other | Mg1Cu1P1O4 | 7 | 82 | 88.48 |
mp-1223057 | 11.442452 | 11.013235 | -3.896645 | other | La1Ag1Mo2O8 | 12 | 82 | 166.16 |
mp-1215591 | 10.023723 | 10.688213 | -3.910542 | other | Yb1Ag1Mo2O8 | 12 | 82 | 158.01 |
mp-2226817 | 7.302206 | 9.912745 | 0.208904 | other | Dy2Mg1Cu4O8 | 15 | 82 | 183.14 |
mp-1105068 | 11.079962 | 11.023495 | 0.461628 | other | Ba1Y1Fe4O7 | 13 | 82 | 187.53 |
mp-1227671 | 12.356072 | 7.281479 | 0.424199 | other | Ca4Al6Mo1O16 | 27 | 82 | 416.29 |
mp-1222503 | 10.413876 | 11.210199 | -2.887735 | other | Li1Eu1W2O8 | 12 | 82 | 160.08 |
mp-1222367 | 11.262942 | 11.163322 | -2.551807 | other | Li1La1W2O8 | 12 | 82 | 168.08 |
mp-1203853 | 6.089895 | 3.655767 | -4.591367 | other | Re4C12O16F4 | 36 | 82 | 661.96 |
mp-1229046 | -5.259053 | -2.815816 | -4.250387 | other | Al1In1Cu2Se4 | 8 | 82 | 189.82 |
mp-1223495 | 11.394127 | 11.096252 | -2.459991 | other | K1La1W2O8 | 12 | 82 | 186.11 |
mp-1219697 | -3.675845 | -1.494365 | -5.556014 | other | Rb3Ag9Sb4S12 | 28 | 82 | 735.73 |
mp-1220703 | 11.262634 | 11.079075 | -3.874538 | other | Na1Y1Mo2O8 | 12 | 82 | 159.55 |
mp-1104863 | 10.163185 | 11.74511 | -0.273934 | other | Ba1Yb1Fe4O7 | 13 | 82 | 186.89 |
mp-1197672 | 8.342475 | 7.136172 | -4.0004 | other | Na12B2Se10O42 | 66 | 82 | 975.38 |
mp-758521 | 9.982821 | 7.822246 | -3.014516 | other | Li4Co4Si4O16 | 28 | 82 | 343.95 |
mp-1222323 | 11.214596 | 11.210382 | -2.559235 | other | Li1Nd1W2O8 | 12 | 82 | 163.09 |
mp-1218503 | 7.621597 | 10.478691 | 1.076317 | other | Sr8Ru1Rh3O16 | 28 | 82 | 397.96 |
mp-2232282 | 7.21339 | 9.873804 | 0.150239 | other | Sm2Mg1Cu4O8 | 15 | 82 | 189.06 |
mp-1221069 | 11.194008 | 11.230796 | -2.606422 | other | Na1Dy1W2O8 | 12 | 82 | 158.34 |
mp-1217432 | -4.81641 | 0.27908 | -4.692272 | other | V20Ga1Ge4S40 | 65 | 82 | 1,135.96 |
mp-1222542 | -6.10639 | -3.335033 | -2.253817 | other | Li1In2Cu1Te4 | 8 | 82 | 259.11 |
mp-8874 | 13.552778 | 4.969571 | -1.977962 | other | Li1Si1B1O4 | 7 | 82 | 68.31 |
mp-1251539 | 8.517475 | 1.215932 | -3.802924 | other | Rb2Al2H16N8 | 28 | 85 | 302.93 |
mp-560133 | 9.119684 | 7.402635 | -1.964571 | other | Tl2Pb16Br18O8 | 44 | 85 | 1,334.73 |
mp-1104904 | 7.880286 | 7.230472 | -4.397973 | other | Cu2B2Cl2O8 | 14 | 85 | 175.14 |
mp-634446 | 8.514205 | 1.213624 | -3.777274 | other | Cs2Al2H16N8 | 28 | 85 | 296.47 |
mp-24515 | 7.676218 | 1.307952 | -3.975734 | other | Rb2Al2H16N8 | 28 | 85 | 376.28 |
mp-1195820 | 11.858485 | 8.295141 | 3.24759 | other | Ho18Sb10C2O8 | 38 | 85 | 876.85 |
mp-1202349 | 8.418818 | 1.052544 | -3.961604 | other | Li2H26C4N8 | 40 | 85 | 401.49 |
mp-1210712 | 7.996897 | 1.092091 | -4.027191 | other | Rb8Al4H16N8 | 36 | 85 | 731.49 |
mp-1237686 | 7.653449 | 0.839697 | -4.040241 | other | Rb8Al4H16N8 | 36 | 85 | 762.16 |
mp-558846 | 11.024201 | 7.784883 | -3.932535 | other | Cs8As16Pd12O56 | 92 | 85 | 1,693.07 |
mp-558364 | 10.17284 | 9.443436 | -2.039489 | other | Cu8Te10Cl8O24 | 50 | 85 | 855.76 |
mp-560923 | 9.455417 | 7.785552 | -1.680114 | original | Ag2Pb8Cl2O8 | 20 | 85 | 437.53 |
mp-559301 | 7.762969 | 2.450811 | -1.217456 | other | Sb2P2Cl8F12 | 24 | 85 | 527.49 |
mp-1193778 | 8.533018 | 1.205728 | -3.762428 | other | Rb2Al2H16N8 | 28 | 85 | 276.6 |
mp-1196632 | 11.789458 | 8.265961 | 3.165406 | other | La18Sb10C2O8 | 38 | 85 | 1,058.2 |
mp-762197 | 8.519162 | 1.201064 | -3.784691 | other | Rb2Al2H16N8 | 28 | 85 | 326.88 |
mp-706910 | 12.186392 | 4.045268 | -3.482193 | other | Mg4B8H24O28 | 64 | 86 | 486.56 |
mp-1196220 | 9.043014 | 3.400911 | -5.76535 | other | Tb4H28C16O44 | 92 | 86 | 1,016.3 |
mp-698287 | 8.352454 | 3.846545 | -5.979287 | other | Y4H8C16O36 | 64 | 86 | 995.99 |
mp-1238179 | 8.595944 | 3.984962 | -5.555412 | other | Yb4H28C16O44 | 92 | 86 | 1,040.64 |
mp-559932 | 8.59696 | 1.659644 | -0.393679 | other | K8Te8O8F24 | 48 | 86 | 855.44 |
mp-572906 | 11.020053 | 11.02984 | -3.61813 | other | Cs8U8Mo12O64 | 92 | 86 | 1,818.81 |
mp-569349 | -4.325722 | -2.606206 | -3.61301 | other | Rb16Hg8P8Se40 | 72 | 86 | 2,407.39 |
mp-1197858 | 8.333586 | 2.44951 | -1.042653 | other | Os8Xe8O24F64 | 104 | 86 | 1,772.78 |
mp-554793 | 9.029597 | 3.411698 | -5.707004 | other | Y4H28C16O44 | 92 | 86 | 994.77 |
mp-705116 | 9.842087 | 11.411737 | 0.782583 | other | Sr8Mn4Mo4O24 | 40 | 86 | 535.02 |
mp-1200794 | 8.731749 | 3.763675 | -5.596171 | other | Yb4H28C16O44 | 92 | 86 | 1,026.72 |
mp-667386 | 8.923152 | 0.940847 | 1.445235 | other | Na12Sr16Al20F104 | 152 | 86 | 2,011.09 |
mp-23925 | 9.719724 | 4.156483 | -4.401671 | other | Tc2H8N2O8 | 20 | 88 | 243.7 |
mp-1236926 | 7.898063 | 4.110175 | -3.592035 | other | Tc4H8N4O8 | 24 | 88 | 237.43 |
mp-641281 | 11.342999 | 11.191583 | -3.768494 | other | Na8Pu2Mo8O32 | 50 | 88 | 778.42 |
mp-1201776 | 5.553005 | 4.900952 | -4.226284 | other | Co4N20Cl4O16 | 44 | 88 | 766.6 |
mp-24128 | 9.402155 | 3.359855 | -4.264141 | original | Re2H8N2O8 | 20 | 88 | 239.36 |
mp-776409 | 7.106484 | 12.499753 | -1.061698 | other | Li24Mg8Ni8O32 | 72 | 88 | 760.15 |
mp-1209706 | 4.596394 | 2.187645 | -3.08045 | other | Rb4B4C8N8 | 24 | 88 | 568.21 |
mp-770591 | 11.511049 | 10.439533 | 0.144905 | other | Li24Mn8Al8O32 | 72 | 88 | 796.25 |
mp-849800 | 9.477341 | 4.925986 | -4.402009 | other | H56S8I8O80 | 152 | 88 | 1,626.14 |
mp-12334 | 4.04879 | 2.257921 | -3.147495 | other | K2Tl2C8N8 | 20 | 88 | 468.64 |
mp-1204501 | 5.373012 | -0.432434 | -3.008383 | other | Cs2Y2B8H32 | 44 | 88 | 555.37 |
mp-1209200 | 7.613745 | 4.074449 | -3.601894 | other | Re4H8N4O8 | 24 | 88 | 262.04 |
mp-6785 | 8.6276 | 1.311595 | 1.747641 | other | K12U4O8F20 | 44 | 88 | 749.18 |
mp-771900 | 10.126154 | 11.467935 | -0.27742 | other | Li24Al8Co8O32 | 72 | 88 | 763.68 |
mp-650814 | 5.805927 | 3.341594 | -4.570713 | other | Ga8Re16C72O72 | 168 | 88 | 2,903.17 |
mp-561234 | 8.652249 | 1.447274 | 1.348314 | other | Ba4Na4Zr8F44 | 60 | 88 | 842.62 |
mp-1020107 | 2.458167 | 2.115954 | 1.719728 | other | Li8Ca8Al24N32 | 72 | 88 | 817.1 |
mp-770491 | 9.375793 | 12.323456 | -0.373699 | other | Li24Al8Ni8O32 | 72 | 88 | 717.14 |
mp-1195932 | 9.806903 | 1.820588 | -3.647384 | other | Sc6H40N10F28 | 84 | 88 | 855.63 |
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