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-22893 | -0.940238 | 2.349626 | -3.017338 | other | Pb1I2 | 3 | 164 | 133.72 |
mp-1206375 | 3.257162 | -0.694027 | -2.335925 | other | Dy1H3 | 4 | 164 | 54.62 |
mp-571122 | -1.012421 | 2.741918 | -3.048301 | other | Fe1I2 | 3 | 164 | 99.4 |
mp-22877 | 1.801977 | 2.378626 | -4.729607 | other | V1Cl2 | 3 | 164 | 69.85 |
mp-1213750 | -6.419443 | -2.636005 | -1.7829 | other | Cr5Te8 | 13 | 164 | 336.9 |
mp-1226072 | -8.002059 | -0.146059 | 3.325507 | other | Co4H1 | 5 | 164 | 44.41 |
mp-1008625 | -5.004977 | -0.038296 | 3.150979 | other | W2C1 | 3 | 164 | 38.19 |
mp-1221498 | -5.140728 | 0.02832 | 3.105177 | other | Mo2C1 | 3 | 164 | 37.52 |
mp-1220660 | -7.257105 | -0.701636 | 3.928861 | other | Nb6Co18 | 24 | 164 | 300.14 |
mp-23224 | -5.872829 | -3.844337 | -1.860148 | other | Bi6Te6 | 12 | 164 | 430.95 |
mp-1223062 | -8.192866 | -6.930234 | 2.846844 | other | La2Ag10 | 12 | 164 | 258.04 |
mp-1009641 | -6.222276 | -2.268382 | -1.032552 | other | Co1Te2 | 3 | 164 | 68.8 |
mp-7655 | -3.981385 | -5.387936 | 5.334793 | other | Ba1Si2 | 3 | 164 | 77.29 |
mp-31473 | -7.067711 | -7.522871 | 1.760036 | other | K2Hg7 | 9 | 164 | 266.43 |
mp-13068 | 10.123851 | 8.438218 | 3.263337 | other | Lu2O3 | 5 | 164 | 61.56 |
mp-971787 | -0.783549 | 0.807397 | -3.969911 | other | V1Br2 | 3 | 164 | 81.19 |
mp-1028441 | -6.098577 | 2.242913 | -5.398208 | other | W4S8 | 12 | 164 | 308.7 |
mp-1023939 | -5.215043 | 1.462363 | -4.346219 | other | Mo2S4 | 6 | 164 | 190.32 |
mp-28116 | 1.156318 | 1.754874 | -4.018626 | other | Ti1Cl2 | 3 | 164 | 73.53 |
mp-753890 | 2.657661 | -0.347235 | -1.448941 | other | Ni2H1 | 3 | 164 | 22.94 |
mp-10901 | -8.294376 | -4.334008 | 3.385926 | original | Al3Pd2 | 5 | 164 | 79.47 |
mp-30761 | -6.438112 | -7.013006 | 3.101926 | other | Li7Pb2 | 9 | 164 | 163.62 |
mp-1180789 | -3.882024 | -6.96588 | 1.789853 | other | K3Rh1 | 4 | 164 | 183.05 |
mp-1205930 | -6.384619 | -6.936206 | 3.927468 | other | Li5Ga4 | 9 | 164 | 132.48 |
mp-11324 | -4.682585 | -1.003111 | -2.907226 | other | Ta1Se2 | 3 | 164 | 70.41 |
mp-21400 | -8.016032 | -3.994457 | 3.166266 | other | Ga3Pt2 | 5 | 164 | 81.84 |
mp-569610 | -0.962328 | 2.27343 | -3.525436 | other | Co1I2 | 3 | 164 | 87.02 |
mp-1215401 | -9.664866 | -4.51875 | 3.735319 | other | Zn1Cu2 | 3 | 164 | 36.39 |
mp-30033 | -0.707403 | 1.232955 | -4.596218 | other | Co1Br2 | 3 | 164 | 77.82 |
mp-7540 | -4.869795 | -3.826939 | 0.60439 | other | Cu6P2 | 8 | 164 | 99.56 |
mp-7088 | -4.607395 | -0.689438 | 3.180645 | other | Ta2C1 | 3 | 164 | 41.5 |
mp-1224692 | -7.725497 | -0.06717 | 3.426564 | other | Fe2Pt1 | 3 | 164 | 37.25 |
mp-1214190 | -4.899978 | -3.404176 | -3.443848 | other | Bi8Se4 | 12 | 164 | 379.81 |
mp-1245668 | -5.357682 | -4.13565 | 0.486829 | other | Cu2As3 | 5 | 164 | 86.82 |
mp-1215 | 12.246985 | 9.29073 | 2.453149 | other | Ti2O1 | 3 | 164 | 36.44 |
mp-399 | -6.170467 | -2.553317 | -1.25259 | other | Te2Pt1 | 3 | 164 | 77.7 |
mp-29803 | -3.658258 | -5.072742 | 5.630789 | other | Si2H2 | 4 | 164 | 74.17 |
mp-22880 | -0.516351 | 1.300137 | -4.564608 | other | Fe1Br2 | 3 | 164 | 79.34 |
mp-821313 | 5.356679 | 11.13518 | -2.50587 | other | Fe1O2 | 3 | 164 | 37.42 |
mp-570259 | 1.389538 | 2.224551 | -5.297654 | other | Mg1Cl2 | 3 | 164 | 68.52 |
mp-1009651 | -7.329615 | -7.765881 | 2.288204 | other | Ca1Hg2 | 3 | 164 | 90.85 |
mp-696114 | 1.556245 | 2.33586 | -5.209306 | other | Co1Cl2 | 3 | 164 | 64.82 |
mp-228 | -6.108287 | -2.319444 | -0.957564 | other | Te2Rh1 | 3 | 164 | 74.02 |
mp-10886 | -8.510568 | -4.140563 | 4.76014 | other | Al3Cu2 | 5 | 164 | 72.4 |
mp-1220726 | 0.550089 | 1.264066 | 2.810052 | other | Nb2N1 | 3 | 164 | 41.93 |
mp-995193 | -4.052913 | -4.835511 | 5.702409 | other | Si6H2 | 8 | 164 | 148.74 |
mp-1221473 | -5.120146 | 0.0074 | 3.104991 | other | Mo3C2 | 5 | 164 | 59.05 |
mp-1229093 | -7.900706 | -7.287069 | 1.863472 | other | Ag2Hg1 | 3 | 164 | 57.41 |
mp-1096986 | 7.922479 | 0.879845 | -4.308763 | other | H2C2 | 4 | 164 | 26.98 |
mp-1222013 | -5.611845 | -5.402501 | 5.375579 | other | Mg1Al2 | 3 | 164 | 53.7 |
mp-30769 | -6.523094 | -6.870317 | 2.930335 | other | Li13Sn5 | 18 | 164 | 320.2 |
mp-985831 | -4.618458 | -1.940245 | -3.195748 | other | Hf1Se2 | 3 | 164 | 78.74 |
mp-1094559 | -6.930985 | -11.030012 | 5.466966 | other | Li2Mg4 | 6 | 164 | 130.87 |
mp-8134 | 11.05732 | 9.424238 | 1.678455 | other | U1O3 | 4 | 164 | 52.18 |
mp-1206728 | -8.124652 | -8.191822 | 3.378346 | other | Tb1Hg2 | 3 | 164 | 74.19 |
mp-755263 | -5.499006 | -0.03545 | -5.511878 | other | Cr1S2 | 3 | 164 | 53.15 |
mp-1065933 | -0.879931 | 1.001268 | -1.773622 | other | Y2I2 | 4 | 164 | 150.16 |
mp-1907 | -5.691902 | -2.387721 | -1.480568 | other | Ti1Te2 | 3 | 164 | 85.09 |
mp-1206683 | -3.443701 | -1.808713 | -5.274156 | other | Pb1S2 | 3 | 164 | 79.33 |
mp-1391 | 8.16705 | 1.399091 | -0.496828 | other | Ag2F1 | 3 | 164 | 44.48 |
mp-1207843 | -4.750295 | 0.055201 | -4.169147 | other | V7S8 | 15 | 164 | 213.43 |
mp-571096 | 1.372059 | 2.429588 | -5.228873 | other | Fe1Cl2 | 3 | 164 | 66.48 |
mp-567567 | -1.206865 | 2.841371 | -3.009129 | other | Cd9I18 | 27 | 164 | 1,049.16 |
mp-1009080 | -7.864672 | -6.826096 | 4.410444 | other | Ho1Cd2 | 3 | 164 | 82.83 |
mp-1094623 | -6.970423 | -10.541299 | 5.161576 | other | Mg4Ga2 | 6 | 164 | 126.2 |
mp-2654 | -4.100734 | -1.271364 | -6.159396 | other | Al12S18 | 30 | 169 | 637.31 |
mp-612740 | -4.778409 | -2.870705 | -3.937051 | other | In12Se18 | 30 | 169 | 895.38 |
mp-685049 | 8.181858 | 2.342634 | -1.110207 | other | I4F28 | 32 | 17 | 446.78 |
mp-568889 | -4.557179 | -2.592283 | -4.18803 | other | Ag8Se4 | 12 | 17 | 267.28 |
mp-1101191 | 10.47518 | 2.619109 | 1.085901 | other | V6F20 | 26 | 17 | 362.14 |
mp-672673 | -4.674553 | -2.493412 | -3.86339 | other | In12Se18 | 30 | 170 | 1,247.02 |
mp-1221583 | -7.641938 | -1.367446 | 3.752387 | other | Mn1Ir1 | 2 | 166 | 25.77 |
mp-1387852 | -5.416167 | -0.520862 | -4.139153 | other | Co1S2 | 3 | 166 | 63.35 |
mp-12283 | -6.454974 | -7.229117 | 3.085021 | other | Li5Tl2 | 7 | 166 | 128.59 |
mp-1105910 | -9.293796 | -5.740273 | 4.013521 | other | Pu2Zn17 | 19 | 166 | 298.53 |
mp-1073456 | -2.446542 | -5.518492 | 7.087985 | other | Mg2Si4 | 6 | 166 | 115.62 |
mp-1189379 | -9.32029 | -1.394125 | 2.883277 | other | Tb4Ni14 | 18 | 166 | 252.45 |
mp-1223675 | -8.151686 | -2.248724 | 3.347295 | other | Ir1Pd1 | 2 | 166 | 29.7 |
mp-1188478 | -9.268299 | -1.47852 | 2.818329 | other | Sm4Ni14 | 18 | 166 | 259.8 |
mp-1103015 | -7.821715 | 0.374371 | 5.716215 | other | Tm3Fe9 | 12 | 166 | 177.71 |
mp-23306 | -1.257319 | 2.440966 | -3.335943 | other | Cu2I2 | 4 | 166 | 115.42 |
mp-1224802 | -8.52544 | -4.498432 | 2.51835 | other | Ga1Pd1 | 2 | 166 | 31.01 |
mp-1225742 | -8.6596 | -5.550601 | 2.2242 | other | Cu1Au4 | 5 | 166 | 85.12 |
mp-1183615 | -5.223055 | -5.752184 | 4.343072 | other | Ca1Np1 | 2 | 166 | 62.37 |
mp-1194918 | -6.627637 | -5.0909 | 0.284516 | other | Bi36Ir9 | 45 | 166 | 1,500.74 |
mp-1220039 | -7.916253 | -2.543131 | 2.651561 | other | Os1Pt4 | 5 | 166 | 77.05 |
mp-1224976 | -8.236267 | -0.006075 | 3.368858 | other | Fe1Ni1 | 2 | 166 | 22.65 |
mp-540884 | 0.733131 | 0.911826 | -3.416189 | other | Y2Cl2 | 4 | 166 | 114.11 |
mp-369 | -6.95557 | -4.365235 | 6.469313 | other | Tb3Al9 | 12 | 166 | 232.94 |
mp-1226026 | -8.126797 | -1.130952 | 3.565273 | other | Co1Rh1 | 2 | 166 | 26.04 |
mp-1102078 | -9.29246 | -1.424986 | 2.919553 | other | Dy3Ni9 | 12 | 166 | 172.18 |
mp-1225044 | -7.474564 | -6.180381 | 6.057242 | other | Er2C1 | 3 | 166 | 65.46 |
mp-1101819 | -7.79688 | 0.341097 | 5.759919 | original | Dy3Fe9 | 12 | 166 | 187.07 |
mp-1095559 | -9.202051 | -1.291812 | 2.779721 | other | Yb3Ni9 | 12 | 166 | 164.63 |
mp-1095601 | -8.663463 | -0.320049 | 4.835436 | other | Yb3Co9 | 12 | 166 | 172.1 |
mp-1228120 | -5.648263 | -4.134178 | 5.929298 | other | Al4Si1 | 5 | 166 | 79.66 |
mp-696746 | -3.151767 | 1.782802 | 2.720517 | other | B12C3 | 15 | 166 | 110.65 |
mp-576 | -3.183867 | 1.734315 | 2.719878 | other | B13C2 | 15 | 166 | 111.34 |
mp-754434 | 1.614978 | 1.707912 | 2.586127 | other | Hf3N4 | 7 | 166 | 84.67 |
mp-1419175 | 10.148839 | 9.811667 | -0.79461 | other | Sb1O2 | 3 | 166 | 46.76 |
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