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-1188146 | -4.712272 | -5.347013 | 0.558278 | other | Ca8As8 | 16 | 60 | 576.24 |
mp-1105681 | 10.319165 | 9.106992 | 0.137924 | original | In8O12 | 20 | 60 | 248.15 |
mp-1197685 | -4.912328 | -0.408858 | 3.104433 | other | Os16C24 | 40 | 60 | 393.62 |
mp-1214386 | 5.804919 | 2.733532 | -3.453103 | other | C56Cl40 | 96 | 60 | 1,795.83 |
mp-560203 | 14.967382 | 5.922122 | 0.05632 | other | Si12O24 | 36 | 60 | 439.04 |
mp-639748 | 15.639881 | 5.613894 | 0.355641 | other | Si36O72 | 108 | 60 | 2,478.78 |
mp-28353 | -6.014164 | -3.424755 | -2.033696 | other | Na24Te24 | 48 | 60 | 1,448.94 |
mp-542233 | -4.803101 | -4.787344 | 0.136742 | other | Rb12As44 | 56 | 60 | 1,903.5 |
mp-1193639 | -4.276814 | -3.357663 | -2.885848 | other | Np8Se20 | 28 | 60 | 641.68 |
mp-9981 | -0.245898 | 2.306531 | 2.188291 | other | Mn8N4 | 12 | 60 | 120.29 |
mp-22192 | -6.177054 | -1.899735 | 5.254707 | other | Si24Ru16 | 40 | 60 | 550.27 |
mp-850068 | -5.474357 | -0.993316 | -4.04719 | other | Ni4S8 | 12 | 60 | 181.9 |
mp-1568 | -3.368993 | -3.916233 | 0.544666 | other | K12P44 | 56 | 60 | 1,556.09 |
mp-773920 | 7.796107 | 10.400106 | -3.797889 | other | Cr20O48 | 68 | 60 | 1,020.37 |
mp-510417 | 10.573917 | 11.17265 | -3.117979 | other | W8O24 | 32 | 60 | 461.42 |
mp-1172828 | 10.663907 | 11.165395 | -3.065952 | other | W8O24 | 32 | 60 | 432.33 |
mp-16610 | -7.119962 | -1.765079 | 4.144488 | other | Ge24Os16 | 40 | 60 | 617.62 |
mp-1188655 | -5.596147 | -1.102509 | -3.103329 | other | Ir8S12 | 20 | 60 | 317.55 |
mp-473 | -3.418757 | -3.923283 | 0.546313 | other | Na12P44 | 56 | 60 | 1,275.91 |
mp-1190124 | 9.506258 | 8.59403 | -0.611117 | other | Bi8O12 | 20 | 60 | 346.19 |
mp-21476 | -6.874564 | 0.545033 | 3.607822 | other | Fe8N4 | 12 | 60 | 112.84 |
mp-669501 | -6.164228 | -1.9685 | 5.312068 | other | Si24Ru16 | 40 | 60 | 563.95 |
mp-1938 | 12.573315 | 7.559809 | 0.339914 | other | Al8O12 | 20 | 60 | 171.32 |
mp-1102412 | 9.25106 | 13.492019 | -1.93401 | other | Cr4O8 | 12 | 60 | 111.77 |
mp-776097 | 10.768094 | 9.944072 | 3.650835 | other | Hf12O24 | 36 | 60 | 442.84 |
mp-2034 | -5.138092 | -0.145289 | 3.192438 | other | W8C4 | 12 | 60 | 152.23 |
mp-13869 | 7.836255 | 10.383714 | -3.769542 | other | Cr20O48 | 68 | 60 | 868.75 |
mp-10948 | 12.608588 | 7.05304 | -1.289129 | other | Si4O8 | 12 | 60 | 94.64 |
mp-1087553 | -4.261649 | -4.980608 | -3.421256 | other | Ce12Se24 | 36 | 60 | 2,162.62 |
mp-1014444 | 0.207703 | 2.189849 | 2.198713 | other | Cr12N8 | 20 | 60 | 183.44 |
mp-1190478 | -8.237777 | -6.246819 | 2.161658 | other | Pb8Au16 | 24 | 60 | 519.89 |
mp-20633 | 5.972905 | 8.783318 | -1.899669 | other | Pb4O8 | 12 | 60 | 165.1 |
mp-1194185 | -3.051798 | -2.292068 | -4.30763 | other | U8S20 | 28 | 60 | 559.96 |
mp-556034 | 6.724038 | 4.97314 | -4.685475 | other | C4O8 | 12 | 60 | 171.6 |
mp-571232 | -0.516521 | 0.933071 | -4.147125 | other | Yb4Br8 | 12 | 60 | 395.16 |
mp-21945 | -7.481314 | -2.057904 | 4.119841 | other | Ge24Ru16 | 40 | 60 | 607.67 |
mp-16608 | -5.883798 | -2.006016 | 5.22014 | other | Si24Os16 | 40 | 60 | 561.86 |
mp-510080 | 8.381111 | 13.423794 | -1.192278 | other | Fe8O12 | 20 | 60 | 207.25 |
mp-1096917 | 0.665359 | 3.138163 | 1.526253 | other | Cr12N24 | 36 | 60 | 568.68 |
mp-555487 | 9.722937 | 10.009984 | 0.05155 | other | Sn12O24 | 36 | 60 | 433.85 |
mp-1080302 | -4.273073 | -4.437989 | -3.429018 | other | Ce4Se8 | 12 | 60 | 388.96 |
mp-17173 | -5.384483 | -0.984475 | -3.60867 | other | Rh8S12 | 20 | 60 | 315.01 |
mp-1080851 | -4.274817 | -4.381773 | -3.410565 | other | Ce12Se24 | 36 | 60 | 1,109.16 |
mp-12978 | 9.687299 | 10.012472 | 0.003491 | other | Sn4O8 | 12 | 60 | 142.89 |
mp-1666 | -2.898459 | -2.509117 | -4.954687 | other | Th8S20 | 28 | 60 | 600.85 |
mp-19342 | 10.56671 | 11.171949 | -3.116001 | other | W8O24 | 32 | 60 | 461.01 |
mp-555136 | 5.145341 | 2.95715 | -3.938728 | other | S16N16 | 32 | 60 | 675.24 |
mp-1105666 | -5.115128 | -1.782697 | -2.690302 | other | Rh8Se12 | 20 | 60 | 367.12 |
mp-1179780 | -5.981889 | -2.429574 | 5.525721 | other | Si24Ru16 | 40 | 60 | 591.87 |
mp-23711 | 3.423158 | -0.615434 | -2.54108 | other | Mg4H8 | 12 | 60 | 118.25 |
mp-1195045 | -1.709361 | 2.327101 | -3.027677 | other | W24I96 | 120 | 60 | 5,472.29 |
mp-2383161 | 10.555868 | 11.173045 | -3.11408 | other | W8O24 | 32 | 60 | 458.8 |
mp-2392 | -4.034658 | -3.910086 | -3.350464 | other | Th8Se20 | 28 | 60 | 690.3 |
mp-1439 | 10.479002 | 12.441511 | 1.803759 | other | Ti4O8 | 12 | 60 | 123.16 |
mp-1552 | -5.160376 | -0.025291 | 3.097787 | other | Mo8C4 | 12 | 60 | 149.1 |
mp-775980 | 10.769634 | 10.044638 | 3.82887 | other | Zr12O24 | 36 | 60 | 460.02 |
mp-1197062 | -3.301778 | -3.868526 | 0.480055 | other | Rb12P44 | 56 | 60 | 1,698.99 |
mp-571642 | 1.184366 | 1.963732 | -5.329565 | other | Ca4Cl8 | 12 | 60 | 334.94 |
mp-568293 | 1.720521 | 1.686934 | 1.352949 | other | Ca12N8 | 20 | 60 | 350.72 |
mp-1015582 | 0.507594 | 2.887465 | 1.809001 | other | Cr4N8 | 12 | 60 | 118.35 |
mp-755749 | 11.414745 | 13.099605 | -0.172345 | other | Cr8O12 | 20 | 60 | 188.93 |
mp-556585 | 10.784077 | 0.609805 | 1.802268 | other | Mn4F8 | 12 | 60 | 153.74 |
mp-628781 | -5.622195 | -3.324553 | -2.041746 | other | Ge8Te8 | 16 | 60 | 604.86 |
mp-541000 | -4.807313 | -4.757803 | 0.129172 | other | K12As44 | 56 | 60 | 1,755.06 |
mp-20648 | -4.890583 | -0.097692 | 2.975843 | other | V8C4 | 12 | 60 | 130.08 |
mp-10913 | 11.43919 | 7.823591 | -1.419405 | other | Ge4O8 | 12 | 60 | 109.78 |
mp-1716 | 8.476792 | 11.66591 | -0.819243 | other | Rh8O12 | 20 | 60 | 203.43 |
mp-775938 | 10.541752 | 12.464546 | 1.861528 | other | Ti12O24 | 36 | 60 | 373.52 |
mp-7709 | 9.125282 | 1.005995 | 0.987194 | other | Zn4F8 | 12 | 60 | 136.18 |
mp-1209834 | -3.143487 | -2.052761 | -4.23062 | other | Np8S20 | 28 | 60 | 552.74 |
mp-684193 | -0.158665 | 0.650669 | -3.172688 | other | Sm44Br96 | 140 | 60 | 4,264.12 |
mp-7228 | 11.710876 | 11.045558 | -0.412336 | other | Re4O8 | 12 | 60 | 125.99 |
mp-863730 | -5.20667 | -7.250302 | 1.953485 | other | K12Tl12 | 24 | 64 | 962.94 |
mp-1200191 | -7.974848 | -3.872265 | 4.727548 | other | Ga42Rh8 | 50 | 64 | 875.26 |
mp-1371 | -7.64168 | -5.105768 | 2.426425 | other | Sn12Pd4 | 16 | 64 | 368.25 |
mp-1105231 | -3.407364 | -4.871902 | 1.174336 | other | Ba10P8 | 18 | 64 | 600.2 |
mp-600041 | 15.668328 | 5.637368 | 0.399263 | other | Si16O32 | 48 | 64 | 882.42 |
mp-32758 | -4.570978 | -2.448028 | -4.242509 | other | Ag4Se2 | 6 | 64 | 124.29 |
mp-1191883 | -6.458215 | -7.396003 | 2.802359 | other | Li12Tl12 | 24 | 64 | 552.1 |
mp-667377 | 15.547919 | 5.676162 | 0.344678 | other | Si56O112 | 168 | 64 | 3,106.95 |
mp-1079707 | 9.370024 | 8.634722 | 2.0826 | other | Ca4O4 | 8 | 64 | 186.12 |
mp-637255 | -6.282319 | -3.838765 | 3.220825 | other | Ti8Sn12 | 20 | 64 | 419.66 |
mp-29647 | -6.055428 | -4.689181 | 1.264579 | other | Sm4Sb8 | 12 | 64 | 347.27 |
mp-1209592 | 9.55964 | 7.466059 | -5.721334 | other | P8O24 | 32 | 64 | 784.76 |
mp-2456335 | -0.035713 | 1.41895 | -4.28604 | other | Pb4Br8 | 12 | 64 | 508.49 |
mp-569054 | -8.446683 | -1.184778 | 5.11074 | other | La4Co6 | 10 | 64 | 201.15 |
mp-667376 | 15.53219 | 5.680618 | 0.339531 | other | Si56O112 | 168 | 64 | 3,108.73 |
mp-32791 | -4.023719 | -1.462654 | -5.473689 | other | Ag4S2 | 6 | 64 | 117.63 |
mp-1071625 | -3.933445 | -2.134352 | -3.538889 | other | C2Se4 | 6 | 64 | 202.32 |
mp-545820 | 11.103679 | 9.127603 | 0.387779 | other | Sn4O4 | 8 | 64 | 153.19 |
mp-734654 | -4.735562 | -2.937279 | -3.794847 | other | K16Se16 | 32 | 64 | 1,036.85 |
mp-856161 | 5.972913 | 13.384231 | -2.567282 | other | Co4O8 | 12 | 64 | 124.2 |
mp-1198538 | -0.934759 | 0.799576 | -3.24292 | other | Ta12Br28 | 40 | 64 | 1,179.58 |
mp-1102139 | -6.066127 | -4.64008 | 1.221413 | other | Nd4Sb8 | 12 | 64 | 356.99 |
mp-1714 | -5.999891 | -1.396987 | 4.451501 | other | Fe8Si16 | 24 | 64 | 292.75 |
mp-1188077 | -7.720066 | -4.187647 | 4.068401 | other | Zr14Cu20 | 34 | 64 | 547.68 |
mp-600051 | 15.674385 | 5.635379 | 0.401113 | other | Si24O48 | 72 | 64 | 1,322.35 |
mp-1103044 | -7.839904 | -4.129252 | 2.792353 | other | Sn8Rh4 | 12 | 64 | 246.96 |
mp-1250551 | 15.530931 | 5.684916 | 0.325563 | other | Si112O224 | 336 | 64 | 6,193.3 |
mp-17123 | -5.692691 | -2.133244 | 5.170612 | other | Si16Os8 | 24 | 64 | 339.35 |
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