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-1218732 | 8.181415 | 9.787315 | 1.364149 | other | Sr14Cu4Hg2Bi2Sb2O30 | 54 | 51 | 823.12 |
mp-605006 | 8.910548 | 2.214448 | -4.637073 | other | Li8H64C16S16N8O40 | 152 | 52 | 1,569.07 |
mp-562114 | 8.46238 | 2.957466 | -4.673025 | other | V8Co4H16C16N8O24 | 76 | 52 | 938.96 |
mp-1221076 | 12.824471 | 6.427551 | -0.482429 | other | Na1Ca1Sc1Zn1Si4O12 | 20 | 5 | 232.83 |
mp-776520 | 13.76371 | 5.761491 | -7.326041 | other | Na2Li2Ti2Al2P6O24 | 38 | 5 | 457.06 |
mp-1234212 | 8.886873 | 1.811845 | 1.90508 | other | Ba6Mg1Sc2C2O6F14 | 31 | 5 | 489.32 |
mp-1223684 | 12.970469 | 6.305327 | -0.746926 | other | K2Na2Mg6Zn4Si24O60 | 98 | 5 | 1,325.43 |
mp-534889 | 12.871023 | 6.673398 | -0.845159 | other | Na3Ca3Mg3Cr3Si12O36 | 60 | 5 | 672.19 |
mp-720332 | 13.059295 | 6.643329 | -0.701386 | other | Na5Ca1Al5Fe1Si12O36 | 60 | 5 | 635.73 |
mp-1173558 | 13.187325 | 7.749245 | -7.426644 | other | Na2Mn4Fe2Ag2P6O24 | 40 | 5 | 471.64 |
mp-1173820 | 13.307687 | 7.41848 | -5.786685 | other | Na4Mn2Cd2Fe2P6O24 | 40 | 5 | 544.58 |
mp-705485 | 12.736013 | 6.464595 | -0.619776 | other | Na1Ca5Sc1Zn5Si12O36 | 60 | 5 | 690.88 |
mp-1235142 | 9.498055 | 9.429422 | 1.699457 | other | Sr4Li1Mn2Cu3S4O4 | 18 | 5 | 302.44 |
mp-2228384 | 9.350121 | 6.12359 | -4.39027 | other | Na1Mg1Cu2H2Se2O10 | 18 | 5 | 222.79 |
mp-1235689 | 9.487461 | 9.443682 | 1.683022 | other | Sr4Li1Mn2Cu3S4O4 | 18 | 5 | 306.58 |
mp-1222576 | 12.253662 | 4.957825 | -5.107272 | other | Mn3Al4Fe1P4H16O28 | 56 | 5 | 539.28 |
mp-1219802 | 12.976295 | 6.299801 | -0.741408 | other | Rb2Na2Mg6Zn4Si24O60 | 98 | 5 | 1,331.33 |
mp-720704 | 12.720804 | 6.482045 | -0.651394 | other | Na1Ca9Sc1Zn9Si20O60 | 100 | 5 | 1,146.75 |
mp-977569 | 8.773561 | 2.035001 | -4.526322 | other | Na2H12C2N4Cl2O4 | 26 | 5 | 289.9 |
mp-1229035 | 13.19499 | 6.940877 | -0.690065 | other | Ba2Ce2Ti2Fe1Si8O26 | 41 | 5 | 588.22 |
mp-752778 | 13.422329 | 6.628829 | -6.732807 | other | Cs4Li4Mn4P12H4O40 | 68 | 5 | 1,051.32 |
mp-721039 | 12.5527 | 6.743993 | -0.702467 | other | Na2Ca6Mg7Fe1Si16O48 | 80 | 5 | 911.47 |
mp-1221075 | 12.368736 | 6.914752 | -1.108364 | other | Na4Ca4Mg4Fe4Si16O48 | 80 | 5 | 902.31 |
mp-684743 | 11.683474 | 4.728789 | -3.610817 | other | Ga1Ge5H6C4N1O12 | 29 | 5 | 387.07 |
mp-1173728 | 12.697525 | 7.349327 | -7.492927 | other | Na4Mn2Cd2Fe2P6O24 | 40 | 5 | 477.8 |
mp-1226397 | 8.987977 | 2.492913 | -4.70048 | other | Cu1H16Pt1C4N4O11 | 37 | 5 | 398.83 |
mp-1226113 | 9.052471 | 2.407824 | -4.65758 | other | Cu1H18Pd1C4N4O11 | 39 | 5 | 398.57 |
mp-1173750 | 13.428159 | 7.083698 | -0.746393 | other | Na3Ca3Al3Fe3Si12O36 | 60 | 5 | 663.65 |
mp-1236434 | 9.472128 | 9.438142 | 1.703639 | other | Sr4Li1Mn2Cu3S4O4 | 18 | 5 | 308.91 |
mp-1173694 | 13.203766 | 6.767804 | -0.699905 | other | Na3Ca3Mg3Cr3Si12O36 | 60 | 5 | 773.93 |
mp-697210 | 8.175273 | 8.667806 | -1.260885 | other | Ca11Y1Al15Cr4Si1O48 | 80 | 5 | 902.99 |
mp-2230838 | 11.755823 | 11.259733 | -1.535001 | other | Mg1Ti2Tl2W2O10F2 | 19 | 5 | 290.24 |
mp-1221089 | 12.86185 | 6.564892 | -0.565975 | original | Na1Ca1Mg1Al1Si4O12 | 20 | 5 | 217.85 |
mp-1223700 | 12.703886 | 5.683344 | -2.079121 | other | Mg1Al8Fe3Si8H16O40 | 76 | 5 | 733.79 |
mp-1233888 | 9.694563 | 9.446218 | 1.769046 | other | Sr4Mg1Mn2Cu3S4O4 | 18 | 5 | 322.67 |
mp-1173587 | 12.777984 | 7.49883 | -6.791865 | other | Na2Mn4Fe2Ag2P6O24 | 40 | 5 | 608.22 |
mp-1221077 | 12.853207 | 6.673079 | -0.863711 | other | Na2Ca2Mg2Cr2Si8O24 | 40 | 5 | 447.31 |
mp-1218546 | 7.662181 | 10.185888 | 1.595333 | other | Sr4Ca1Y1Ga2Cu4O14 | 26 | 5 | 344.91 |
mp-1217853 | 8.618032 | 3.729288 | -5.998263 | other | Sr1Zr1Cd1H8C8O22 | 41 | 5 | 570.02 |
mp-534793 | 12.766762 | 6.545829 | -0.506643 | other | K1Ca5Mg5Al1Si12O36 | 60 | 5 | 678.73 |
mp-1233034 | 9.185811 | 7.48842 | -4.463986 | other | Ba1Mg1Al3P2H2O14 | 23 | 5 | 252.84 |
mp-1216341 | 11.439787 | 7.087099 | -3.943695 | other | Zn9Si2Te3P4Pb9O42 | 69 | 5 | 1,001.51 |
mp-1209124 | 8.340004 | 9.208736 | 1.106998 | other | Sr4Ca2Cu4Bi4I2O16 | 32 | 53 | 546.58 |
mp-1212132 | 4.249012 | 2.357999 | -3.179507 | other | K6Na2Mo2C8N8O4 | 30 | 53 | 772.74 |
mp-556641 | 12.925886 | 5.355594 | -6.031281 | other | Na16Li8Al8P16H16O72 | 136 | 54 | 1,423.49 |
mp-13726 | 12.767775 | 6.316266 | -0.495178 | other | Na12Sr4La4Zn4Si24O68 | 116 | 54 | 1,539.39 |
mp-649756 | 7.208298 | 2.857331 | -2.675115 | other | Ag4As4S24N16O8F24 | 80 | 54 | 1,470.59 |
mp-1179600 | 8.340199 | 2.337583 | -4.594283 | other | Zn4H64C16S16N40O24 | 164 | 56 | 2,355.05 |
mp-707466 | 8.287687 | 3.337476 | -3.28774 | other | H4C8S8N4O16F24 | 64 | 56 | 895.56 |
mp-706601 | 8.373825 | 2.396762 | -4.623834 | other | Zn4H64C16S16N40O24 | 164 | 56 | 2,102.71 |
mp-557395 | 8.180782 | 3.473449 | -3.554477 | other | Li4C8S8N4O16F24 | 64 | 56 | 901.49 |
mp-1198217 | 8.939301 | 2.328058 | -4.526155 | other | Zn12H96C16Se20N48O60 | 252 | 57 | 2,956.4 |
mp-1202565 | 9.195728 | 1.70199 | -4.529804 | other | Ga4P8H60C20N8O32 | 132 | 58 | 1,304.48 |
mp-1197419 | 12.380795 | 6.792911 | -0.644323 | other | Rb12Na2U6Si8O40F2 | 70 | 58 | 1,238.97 |
mp-695945 | 5.034277 | 2.645918 | -3.838141 | other | Na8H16Ru4C20N24O12 | 84 | 58 | 1,220.17 |
mp-690698 | 7.648921 | 2.164516 | -1.601749 | other | Ag2Sb2H4C4N4F12 | 28 | 58 | 467.23 |
mp-540591 | 5.226945 | 2.626515 | -3.922036 | other | Na8Fe4H16C20N24O12 | 84 | 58 | 1,153.08 |
mp-722188 | 12.495922 | 5.295293 | -2.403731 | other | Na2Ca8Si16H32O56F2 | 116 | 58 | 1,285.55 |
mp-559419 | 12.634838 | 6.37232 | -0.714435 | other | Ba18Li2Si20C2Cl14O56 | 112 | 59 | 2,022.18 |
mp-1196395 | 9.254332 | 1.821567 | -4.209614 | other | Co4H72S8Br4N24O16 | 128 | 55 | 1,316.5 |
mp-705014 | 8.015718 | 2.807992 | -2.359514 | other | Ni8P16C44S8O12F96 | 184 | 60 | 2,902.15 |
mp-772852 | 12.563414 | 5.089979 | -5.732462 | other | Na12Zn16P16H16N4O64 | 128 | 60 | 1,535.63 |
mp-1202516 | 4.429309 | 3.010471 | -3.751015 | other | Hg4H16C8S8N24Cl8 | 68 | 60 | 1,965.66 |
mp-1200704 | 8.324144 | 1.214752 | -4.51085 | other | H112C40S8N24Cl8O16 | 208 | 60 | 2,422.72 |
mp-6902 | 8.14939 | 3.525704 | -3.581633 | other | K16C32S32N16O64F96 | 256 | 60 | 4,062.66 |
mp-1196575 | 8.376534 | 1.165659 | -4.483923 | other | H64C16S8Br8N8O8 | 112 | 60 | 1,348.61 |
mp-774723 | 8.830651 | 2.490947 | -4.735046 | other | Cu4H48C12S4N24O28 | 120 | 60 | 1,116.36 |
mp-720283 | 7.392848 | 2.255122 | -4.368453 | other | K8H24Pt4C16N16O12 | 80 | 60 | 1,118.67 |
mp-1204048 | 8.094967 | 1.845255 | -4.357406 | other | B8H104C32N80Cl8O4 | 236 | 60 | 2,403.53 |
mp-761258 | 14.405081 | 7.620786 | -6.47191 | other | Li12Mn4Fe4Co4P12O48 | 84 | 6 | 907.74 |
mp-2231511 | 11.574818 | 9.657982 | 2.408257 | other | K2Na2Pr2Mg1Nb2O10 | 19 | 6 | 302.58 |
mp-1227606 | 7.63945 | 9.826849 | 1.259982 | other | Ba1Sr1Y1Tl1Cu2O7 | 13 | 6 | 186.23 |
mp-764969 | 14.39608 | 7.618535 | -6.480114 | other | Li12Mn4Fe4Co4P12O48 | 84 | 6 | 905.61 |
mp-766588 | 9.867046 | 3.90314 | -7.824156 | other | Li12V3Co1P4C4O28 | 52 | 6 | 557.34 |
mp-1234626 | 11.849299 | 7.306149 | -4.185279 | other | Mg1Cd4Cu4As4H4O20 | 37 | 6 | 455.36 |
mp-1177594 | 14.396261 | 7.629971 | -6.49279 | other | Li12Mn4Fe4Co4P12O48 | 84 | 6 | 911.45 |
mp-757146 | 9.588786 | 3.660415 | -8.634081 | other | Li12Mn2Fe2P4C4O28 | 52 | 6 | 560.31 |
mp-2242141 | 10.747093 | 10.128119 | 1.673047 | other | Ba1Y1Mg1Cr1Cu1O5 | 10 | 6 | 157.6 |
mp-766535 | 9.994284 | 4.057199 | -7.638763 | other | Li12V3Fe1P4C4O28 | 52 | 6 | 558.36 |
mp-766533 | 9.747968 | 3.850087 | -8.372437 | other | Li12Cr3Fe1P4C4O28 | 52 | 6 | 559.63 |
mp-766534 | 9.668078 | 3.778745 | -8.366117 | other | Li12Cr1Fe3P4C4O28 | 52 | 6 | 553.35 |
mp-861267 | 9.918266 | 3.975213 | -7.815609 | other | Li12Mn1V3P4C4O28 | 52 | 6 | 561.98 |
mp-753777 | 9.546977 | 3.62084 | -8.496688 | other | Li6Fe1Co1P2C2O14 | 26 | 6 | 267.79 |
mp-766814 | 9.512286 | 3.669368 | -8.656452 | other | Li12Mn1Co3P4C4O28 | 52 | 6 | 548.99 |
mp-768847 | 9.425628 | 3.869123 | -8.216663 | other | Na10Li2Ni4P4C4O28 | 52 | 6 | 608.66 |
mp-766513 | 9.402822 | 3.830008 | -8.651803 | other | Li12Mn1Ni3P4C4O28 | 52 | 6 | 538.18 |
mp-1227794 | 7.081102 | 9.898721 | 0.614576 | other | Ba1Sr1Ca2Tl1Cu3O9 | 17 | 6 | 232.4 |
mp-764707 | 14.400218 | 7.628434 | -6.488627 | other | Li12Mn4Fe4Co4P12O48 | 84 | 6 | 910.66 |
mp-2240418 | 11.675138 | 9.90835 | 2.13872 | other | Ba1Y1Mg1Ti1Cu1O5 | 10 | 6 | 156.41 |
mp-757178 | 9.524431 | 3.647524 | -8.716756 | other | Li12Mn2Co2P4C4O28 | 52 | 6 | 555.31 |
mp-753882 | 9.721085 | 3.729453 | -8.289786 | other | Li6Mn1V1P2C2O14 | 26 | 6 | 281.33 |
mp-753761 | 9.637623 | 3.687589 | -8.575717 | other | Li6Mn1Cr1P2C2O14 | 26 | 6 | 281.88 |
mp-1228542 | 12.126539 | 6.577797 | 0.165891 | other | Ba2Sr3Ca1Mg2Si4O16 | 28 | 6 | 375.11 |
mp-977011 | 8.252032 | 1.529276 | -4.103109 | other | H3Pb1C1I3N1F3 | 12 | 6 | 274.68 |
mp-1178079 | 9.707582 | 3.79414 | -8.495728 | other | Li12Mn1Cr3P4C4O28 | 52 | 6 | 562.44 |
mp-1233740 | 8.884938 | 1.785969 | 1.922481 | other | Ba6Mg1Sc2C2O6F14 | 31 | 6 | 541.61 |
mp-766539 | 9.428697 | 3.805566 | -8.594047 | other | Li12Fe1Ni3P4C4O28 | 52 | 6 | 535.23 |
mp-1235047 | 8.061157 | 9.971943 | 1.638434 | other | Ba2Li1Sm1Co1Cu2O7 | 14 | 6 | 191.48 |
mp-766677 | 9.504171 | 3.702948 | -8.546237 | other | Li12V1Ni3P4C4O28 | 52 | 6 | 541.31 |
mp-757109 | 9.675266 | 3.689108 | -8.269337 | other | Li12V2Co2P4C4O28 | 52 | 6 | 552.69 |
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