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-1236003 | 10.500172 | 9.399053 | -0.715027 | other | Li1Bi3Pb1W1Cl1O8 | 15 | 25 | 252.62 |
mp-2226976 | 9.342895 | 10.385016 | 1.575643 | other | Ba1Y1Mg1Cu1Ni1O5 | 10 | 25 | 146.61 |
mp-2224832 | 10.511842 | 3.997014 | -3.921278 | other | Mg1Cu1H4Pb2Cl2O4 | 14 | 25 | 227.77 |
mp-2228066 | 11.703419 | 10.654847 | 2.691023 | other | La1Mg1Nb2Cu1Cl1O7 | 13 | 25 | 194.81 |
mp-1235322 | 8.175976 | 9.821869 | 1.639582 | other | Ba2Li1Sm1Co1Cu2O7 | 14 | 25 | 195.14 |
mp-2228604 | 8.314896 | 9.672951 | 1.57364 | other | Sr2Y1Mg1Tl1Cu2O7 | 14 | 25 | 207.69 |
mp-2240838 | 13.621941 | 8.677141 | -7.722307 | other | Mg1Mn1V1P2O8F2 | 15 | 2 | 185.64 |
mp-699555 | 6.061589 | 3.385381 | -4.492988 | other | Cr4C26S2N6O20F10 | 68 | 2 | 1,101.46 |
mp-1236332 | 10.137717 | 1.734124 | -1.407103 | other | Li1Al2H4Pb2O4F6 | 19 | 2 | 226.09 |
mp-1197210 | 10.917045 | 3.789207 | -4.807503 | other | K2Na4P6H14N6O16 | 48 | 2 | 535.95 |
mp-535004 | 9.691924 | 2.177258 | -4.44896 | other | Zn8P12H76C16N8O48 | 168 | 2 | 1,646.92 |
mp-1234116 | 13.570182 | 6.334738 | -5.617801 | other | K2Mg1Zn4P4H2O16 | 29 | 2 | 434.19 |
mp-572874 | 8.633774 | 1.176933 | -4.346132 | other | Al2H28C8N2O2F8 | 50 | 2 | 566.35 |
mp-772728 | 9.701881 | 3.577921 | -8.549877 | other | Na10Li2Mn4P4C4O28 | 52 | 2 | 630.9 |
mp-759811 | 14.23554 | 7.823311 | -6.563926 | other | Li4V2Cr2P4H4O20 | 36 | 2 | 362.95 |
mp-2220391 | 10.1038 | 9.984846 | 2.785965 | other | Ba6Mg1Nb2Ir1Cl2O12 | 24 | 2 | 497.6 |
mp-1232383 | -4.446153 | 0.712506 | 2.949619 | other | Hf2Ta2Ti2B8Mo2C8 | 24 | 2 | 212.27 |
mp-24664 | 8.371636 | 1.892764 | -4.523288 | other | Zn2H16C4N8Cl4O4 | 38 | 2 | 472.99 |
mp-1200481 | 7.834795 | 0.143791 | -4.451946 | other | Yb4Si16H144C48N8Cl4 | 224 | 2 | 2,866.08 |
mp-561074 | 8.38345 | 1.44958 | -4.546009 | other | H56Rh4C24N4Cl4O16 | 108 | 2 | 1,160.04 |
mp-735910 | 12.576162 | 6.52572 | -0.755268 | other | K3Li5Al6Si10O30F6 | 60 | 2 | 842.81 |
mp-2229489 | 14.046317 | 7.828361 | -6.639151 | other | Mg1V1Cr1P2H2O10 | 17 | 2 | 182.08 |
mp-1180029 | 5.956793 | 3.885671 | -4.04561 | other | Pb1C6S6N12Cl2O8 | 35 | 2 | 749.04 |
mp-778070 | 13.256667 | 7.819017 | -7.279069 | other | Li4Mn2V2P4H4O20 | 36 | 2 | 367.59 |
mp-757218 | 10.276098 | 4.649984 | -4.243707 | other | K4Na2H18Pd1I2O20 | 47 | 2 | 527.81 |
mp-24828 | 12.774979 | 5.625507 | -5.995177 | other | Ba4Co4B4P8H4O36 | 60 | 2 | 718.57 |
mp-557010 | 6.422931 | 3.28799 | -3.427824 | other | Cd1As2S18N12O6F12 | 51 | 2 | 1,014.37 |
mp-776504 | 13.673306 | 8.524457 | -7.934722 | other | Li6Mn3V3P6O24F6 | 48 | 2 | 550.74 |
mp-556077 | 8.233327 | 10.164301 | -3.395592 | other | Zn1Cr6Si2Pb10O32F2 | 53 | 2 | 830.77 |
mp-554598 | 8.829767 | 1.33934 | -4.41383 | other | B4H20C4N2Cl2O6 | 38 | 2 | 396.4 |
mp-1214326 | 8.373195 | 2.70459 | -4.966431 | other | Ca2H16C12S4N4O16 | 54 | 2 | 624.98 |
mp-696020 | 9.140512 | 3.520609 | -4.593529 | other | Ca2Re4H12C2N4O20 | 44 | 2 | 571.38 |
mp-1227826 | 12.639626 | 6.577376 | -0.64518 | other | Ca4Al5Cr1Si6H2O26 | 44 | 2 | 471.75 |
mp-1197884 | 9.52424 | 3.349841 | -3.982235 | other | V1H17C4S4O20F12 | 58 | 2 | 680.66 |
mp-695698 | 12.626423 | 6.527018 | -0.559898 | other | Ca4Ti2Al2Si4O18F2 | 32 | 2 | 368.83 |
mp-1202461 | 13.29493 | 6.832124 | -0.91344 | other | Li2Ca4Mn4Si10H2O30 | 52 | 2 | 588.81 |
mp-24273 | 9.065936 | 2.401202 | -4.586586 | other | Cd1H20C4S4N2O12 | 43 | 2 | 452.49 |
mp-1197579 | 6.117103 | 3.328935 | -4.405459 | other | Cr2H2C14N2O10F4 | 34 | 2 | 574.55 |
mp-1205047 | 8.08032 | 0.93061 | -4.458853 | other | Ag4H144C60S12N24Cl4 | 248 | 2 | 2,728.93 |
mp-735824 | 12.666668 | 6.654838 | -1.805561 | other | K5Li10Al5Si20O50F10 | 100 | 2 | 1,337.95 |
mp-760016 | 11.628085 | 7.983227 | -7.23932 | other | Li2V2Fe2P4H4O20 | 34 | 2 | 360.93 |
mp-760143 | 14.358327 | 8.512646 | -7.202137 | other | Li4V2Cr2P4O16F4 | 32 | 2 | 361.58 |
mp-760163 | 11.642441 | 7.979763 | -7.231431 | other | Li2V2Fe2P4H4O20 | 34 | 2 | 359.81 |
mp-1208461 | 8.343038 | 2.229081 | -4.57532 | other | U1Cr4H48C14N30O22 | 119 | 2 | 1,240.55 |
mp-1198862 | 8.694562 | 2.050192 | -4.598841 | other | Zn2H20C4S6N12O8 | 52 | 2 | 591.6 |
mp-1221041 | 12.844621 | 5.887866 | -1.458755 | other | Na8Zr3Si16Sn1H16O52 | 96 | 2 | 1,154.98 |
mp-1212169 | 8.109205 | 2.623635 | -5.157798 | other | K4Cd2H4C16N12O16 | 54 | 2 | 769.45 |
mp-1201658 | 12.016711 | 4.617454 | -4.976717 | other | Mn2Al4P4H20O26F4 | 60 | 2 | 589.87 |
mp-1200727 | 7.933552 | 1.732797 | -4.478798 | other | H38Pb2C30S4N6O10 | 90 | 2 | 1,095.46 |
mp-1204695 | 8.132147 | 0.870261 | -4.497874 | other | Tc3H36C12S6Cl12O6 | 75 | 2 | 1,177.76 |
mp-771003 | 9.560392 | 3.525253 | -8.617976 | other | Na2Li4Mn2P2C2O14 | 26 | 2 | 301.07 |
mp-707816 | 8.619541 | 3.936038 | -4.509295 | other | H10C2S2N4Cl2O8 | 28 | 2 | 382.69 |
mp-1202148 | 7.784204 | 1.373599 | -4.277014 | other | B2P8H72Rh2C72F40 | 196 | 2 | 2,215.94 |
mp-1348675 | 7.752668 | 3.907249 | -2.734494 | other | Ni1H44C12N8Cl2O10 | 77 | 2 | 706.9 |
mp-1196643 | 8.071463 | 3.739039 | -3.645677 | other | Li8C16S16N8O40F48 | 136 | 2 | 1,984.02 |
mp-776501 | 13.678715 | 8.526533 | -7.932303 | other | Li4Mn2V2P4O16F4 | 32 | 2 | 367.19 |
mp-1190639 | 14.238393 | 7.419207 | -5.729279 | other | Cs2K4Fe6P8Cl2O28 | 50 | 2 | 786.41 |
mp-558106 | 8.529451 | 1.946998 | -4.491208 | other | Sn1H58C16S4N22O18 | 119 | 2 | 1,215.57 |
mp-656345 | 7.562762 | 4.488746 | -2.196313 | other | B4H20C4N2Cl2O6 | 38 | 2 | 396.4 |
mp-1216219 | 10.444257 | 3.445599 | -4.501925 | other | Zn3Cr1H80S8N8O56 | 156 | 2 | 1,422.28 |
mp-1201227 | 8.008104 | 1.575237 | -4.479471 | other | H48Au2C32S4N6O8 | 100 | 2 | 1,209.82 |
mp-1205055 | 5.89452 | 4.064069 | -4.26041 | other | Te2C8S8N16Cl4O16 | 54 | 2 | 1,354.56 |
mp-693409 | 12.572506 | 6.562913 | -0.714476 | other | Ca10Ti8Nb1Al1Si10O50 | 80 | 2 | 952.12 |
mp-1100964 | 8.611738 | 1.944008 | -4.561247 | other | U2P2H20C8N4O16 | 52 | 2 | 706.24 |
mp-1204845 | 8.561946 | 2.784239 | -4.617589 | other | H14C4S2N8Cl2O8 | 38 | 2 | 510.71 |
mp-1199919 | 11.744661 | 6.620692 | -6.701603 | other | K4Mn2P4H4O16F4 | 34 | 2 | 483.21 |
mp-720849 | 7.348602 | 2.304118 | -4.394892 | other | Na8H24Pt4C16N16O12 | 80 | 2 | 1,036.3 |
mp-1210735 | 8.380985 | 2.657096 | -5.000995 | other | Mg1H8C6S2N2O8 | 27 | 2 | 297.56 |
mp-708999 | 8.216628 | 0.722435 | -4.462571 | other | K2Sn4H72C24Se12N6 | 120 | 2 | 1,547.14 |
mp-1201666 | 10.37962 | 4.794958 | -4.531927 | other | V12Co1H24C8N2O32 | 79 | 2 | 1,033.55 |
mp-759379 | 11.596204 | 7.994134 | -7.47693 | other | Li2Mn2V2P4H4O20 | 34 | 2 | 360.68 |
mp-1177881 | 13.233799 | 7.809826 | -7.268606 | other | Li6Mn3V3P6H6O30 | 54 | 2 | 546.73 |
mp-1203169 | 8.763887 | 2.866908 | -4.736552 | other | U2H26C6N12Cl2O20 | 68 | 2 | 765.2 |
mp-557494 | 8.237989 | 2.342188 | -1.056802 | other | Ag4B4Te16C8O24F80 | 136 | 2 | 2,348.54 |
mp-24272 | 8.990831 | 2.321591 | -4.575934 | other | Ca1H20C4S4N2O12 | 43 | 2 | 466.32 |
mp-1233305 | 13.518942 | 6.861161 | -6.697701 | other | K2Mg1Mn2P6H2O20 | 33 | 2 | 453.62 |
mp-1233022 | 13.385662 | 7.385871 | -5.882385 | other | Mg1Co6Ag2P6H4O24 | 43 | 2 | 466.74 |
mp-1233986 | 10.294888 | 1.76508 | -1.193633 | other | Ca1Al2H4Pb2O4F6 | 19 | 2 | 242.26 |
mp-760167 | 14.237628 | 7.823142 | -6.556931 | other | Li6V3Cr3P6H6O30 | 54 | 2 | 543.5 |
mp-760034 | 13.442673 | 7.853678 | -6.893274 | other | Li6V3Fe3P6H6O30 | 54 | 2 | 549.75 |
mp-1340838 | 7.976045 | 3.798812 | -1.622355 | other | Li2Mg1Zr2H4O4F12 | 25 | 2 | 309.78 |
mp-1214060 | 13.202024 | 5.667766 | -6.544991 | other | Ca2Mg10P6H2C2O32 | 54 | 2 | 597.46 |
mp-1202403 | 8.697674 | 3.43396 | -6.077046 | other | Na2U2Zn1H8C12O28 | 53 | 2 | 610.16 |
mp-726800 | 13.672663 | 6.460608 | -1.656885 | other | Mn4Si4Sn1B2H2O18 | 31 | 2 | 352.68 |
mp-1199714 | 8.165863 | 0.878855 | -4.375008 | other | Hg2P10H54C22O12F12 | 112 | 2 | 1,465.61 |
mp-1200644 | 8.468736 | 1.631569 | -4.272056 | other | Ca1H36W6C12S6O25 | 86 | 2 | 1,142.39 |
mp-727288 | 9.421882 | 2.876469 | -4.708985 | other | V4H80C8S8N24O52 | 176 | 2 | 1,719.36 |
mp-1192972 | 7.502816 | 4.786839 | -4.374097 | other | Pb2C6S4N2O8F4 | 26 | 2 | 561.32 |
mp-1194277 | 7.86709 | 1.37584 | -4.44943 | other | Cr1H12C8S2N2O2 | 27 | 2 | 370.94 |
mp-1228335 | 10.410508 | 7.140462 | -5.572695 | other | Ba4Ti1Al3P4O20F4 | 36 | 2 | 469.31 |
mp-1177823 | 13.430466 | 7.848248 | -6.895291 | other | Li4V2Fe2P4H4O20 | 36 | 2 | 365.09 |
mp-774726 | 8.418553 | 1.940612 | -4.518518 | other | Cu4H52C12S14N24O10 | 116 | 2 | 1,309.34 |
mp-1386711 | 7.533287 | 5.023454 | -1.817479 | other | Ga2Ge4H10C2N2O12 | 32 | 2 | 358.34 |
mp-2226915 | 14.208549 | 8.390963 | -7.229212 | other | Mg1V1Cr1P2O8F2 | 15 | 2 | 182.28 |
mp-1233087 | 13.970632 | 6.990738 | -4.924076 | other | Sr2Ca1Zn2Sn2P4O16 | 27 | 2 | 406.73 |
mp-555028 | 7.946466 | 2.264539 | -1.244117 | other | Ag1Sb1Te6S16O6F30 | 60 | 2 | 1,252.75 |
mp-1234634 | 10.457376 | 1.94079 | -1.270533 | other | Mg1Al2H4Pb2O4F6 | 19 | 2 | 230.71 |
mp-1218734 | 7.786996 | 9.891483 | 1.43703 | other | Sr4Ca1Y1Cu6Pb4O16 | 32 | 2 | 467.93 |
mp-1260618 | 13.114122 | 6.835111 | -0.855059 | other | K3Ca2Mg10Si16H4O48 | 83 | 2 | 994.25 |
mp-721789 | 8.241635 | 1.815369 | -4.451006 | other | Cu2H36C8N20Cl4O4 | 74 | 2 | 760.66 |
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