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-961646 | -5.917678 | -2.255624 | -0.642709 | other | Ti1Te1Os1 | 3 | 216 | 58.73 |
mp-1077082 | -9.186305 | -1.458275 | 2.791739 | other | Tb1Cd1Ni4 | 6 | 216 | 84.71 |
mp-1215252 | -6.096974 | -1.335934 | 3.895195 | other | Zr1Al1W4 | 6 | 216 | 108.07 |
mp-631551 | -6.843518 | -1.501983 | 4.792727 | other | Mn1Al1Tc1 | 3 | 216 | 49.4 |
mp-30582 | -8.044241 | -7.493099 | 3.176126 | other | Hf1Cu1Hg2 | 4 | 216 | 75.9 |
mp-1221375 | -3.958605 | -5.990755 | 4.781144 | other | Na2Ca1Si1 | 4 | 216 | 98.8 |
mp-3726 | -7.944823 | -5.246467 | 3.32547 | other | Li2Ga1Pt1 | 4 | 216 | 54.14 |
mp-1221620 | -7.263234 | -0.053461 | 4.152052 | other | Mn1Al1Fe2 | 4 | 216 | 49.18 |
mp-16246 | -6.418805 | -5.437392 | 0.822267 | other | Cd1Sb1Au1 | 3 | 216 | 72.02 |
mp-30466 | -6.533361 | -5.138371 | 0.882161 | other | Yb1Bi1Pd1 | 3 | 216 | 77.8 |
mp-1009547 | -4.473029 | -5.735418 | 0.637731 | other | Cs1Rb1As1 | 3 | 216 | 156.11 |
mp-1071645 | -9.459913 | -4.787406 | 4.108274 | other | Y1In1Cu4 | 6 | 216 | 92.46 |
mp-1071839 | -9.200838 | -4.41337 | 3.947336 | other | U1Cu4Au1 | 6 | 216 | 91.26 |
mp-1100393 | -4.796807 | -2.751316 | -4.008248 | other | Li1Ag1Se1 | 3 | 216 | 56.04 |
mp-961656 | -6.08122 | -2.0133 | -0.494878 | other | V1Fe1Te1 | 3 | 216 | 49.62 |
mp-631435 | -5.766925 | -1.169557 | 3.595124 | other | Re1Ru1Br1 | 3 | 216 | 56.43 |
mp-962061 | -6.95435 | -7.281357 | 5.270325 | other | Y1Mg1Tl1 | 3 | 216 | 91.66 |
mp-1206720 | -6.533945 | -5.098722 | 0.84241 | other | Pr1Bi1Pd1 | 3 | 216 | 80.86 |
mp-1206095 | -9.576313 | -4.869075 | 4.125865 | other | Sm1In1Cu4 | 6 | 216 | 94.68 |
mp-631319 | -5.764522 | -2.850293 | 4.581694 | other | Li1Ti1Re1 | 3 | 216 | 52.98 |
mp-1072553 | -9.139575 | -1.454234 | 2.829017 | other | Tm1Cd1Ni4 | 6 | 216 | 82.78 |
mp-631696 | -6.503669 | -5.909238 | 4.229738 | other | Ca2Co1W1 | 4 | 216 | 78.73 |
mp-1222785 | -6.991521 | -4.639781 | 6.401787 | other | La1Nd1Al4 | 6 | 216 | 131.74 |
mp-22276 | -7.455682 | -0.845438 | 3.537489 | other | Mn2In1Co1 | 4 | 216 | 58.84 |
mp-1222695 | -7.869969 | -9.174728 | 6.642585 | other | La1Y1Mg4 | 6 | 216 | 162.69 |
mp-568466 | -6.564995 | -6.791141 | 2.452837 | other | Li1In1Sn1 | 3 | 216 | 78.02 |
mp-1071051 | -9.608547 | -4.753119 | 4.321186 | other | Nd1Mg1Cu4 | 6 | 216 | 95.74 |
mp-1207519 | -8.811634 | -1.618427 | 2.767551 | other | Yb1Ni4Sn1 | 6 | 216 | 83.77 |
mp-961648 | -3.558404 | -4.981826 | 1.12044 | other | K1Ba1P1 | 3 | 216 | 99.86 |
mp-631458 | -5.705611 | -6.074449 | 1.013587 | other | Ca1Re1Bi1 | 3 | 216 | 77.12 |
mp-37906 | 2.189117 | 2.221462 | 1.509674 | other | Li1Mg1N1 | 3 | 216 | 30.45 |
mp-1213974 | -8.210297 | -6.314315 | 1.952084 | other | Ca1Bi1Au4 | 6 | 216 | 127.8 |
mp-1227289 | -5.254084 | -1.107387 | 4.570872 | other | Be4Co1Ge1 | 6 | 216 | 55.28 |
mp-1206218 | -9.085914 | -1.656915 | 2.825992 | other | Nd1In1Ni4 | 6 | 216 | 88.68 |
mp-631464 | -3.159983 | -7.679643 | 1.809575 | other | K1Be1Pt1 | 3 | 216 | 69.2 |
mp-961675 | -5.793351 | -1.773025 | 1.222508 | other | Sc1Ni1P1 | 3 | 216 | 45.67 |
mp-1217206 | 12.1988 | 9.040524 | 2.489115 | other | Ti16Cu8O4 | 28 | 216 | 377.1 |
mp-631303 | -6.221045 | -1.751424 | 3.713247 | other | In1Re1Ge1 | 3 | 216 | 61.16 |
mp-30848 | -7.314797 | -4.031882 | 3.174994 | other | U1Sn1Pt1 | 3 | 216 | 73.92 |
mp-570213 | -5.959836 | -6.10864 | 0.505119 | other | Li1Mg1Bi1 | 3 | 216 | 77.94 |
mp-631408 | -3.402169 | -5.732155 | 5.693053 | other | K1Si2Hg1 | 4 | 216 | 94.02 |
mp-631256 | -6.748149 | -0.025412 | 3.680603 | other | Fe1Ni1Mo1 | 3 | 216 | 43.41 |
mp-1224275 | -6.057984 | -1.565723 | 3.964235 | other | Hf1Ta1V4 | 6 | 216 | 93.95 |
mp-866208 | -6.380158 | -6.832866 | 4.04647 | other | Yb16Mg4Pd4 | 24 | 216 | 734.16 |
mp-1077397 | -8.992474 | -1.473018 | 2.896564 | other | Sc1Cd1Ni4 | 6 | 216 | 79.34 |
mp-1211003 | -7.997418 | -6.441484 | 6.508756 | other | Lu16Mg4Ni4 | 24 | 216 | 588.76 |
mp-605878 | -7.604867 | -6.280509 | 6.474615 | other | La16Mg4Ru4 | 24 | 216 | 734.52 |
mp-1228748 | -4.692282 | -0.885786 | -5.97135 | other | Al4Cr1S8 | 13 | 216 | 242.11 |
mp-35555 | 8.540324 | 1.981302 | 2.472932 | other | La1O1F1 | 3 | 216 | 47.96 |
mp-10180 | -6.123472 | -4.978873 | 0.764525 | other | Li2Sb1Pd1 | 4 | 216 | 63.65 |
mp-1207825 | -7.568929 | -6.59042 | 6.617343 | other | Y16Mg4Ni4 | 24 | 216 | 641.32 |
mp-1100401 | -5.928891 | -6.61521 | 4.870069 | other | Y1Cd1B1 | 3 | 216 | 57.72 |
mp-1206953 | -6.701561 | -4.994891 | 0.858251 | other | Er1Bi1Pd1 | 3 | 216 | 73.25 |
mp-636297 | -6.63691 | -3.848297 | 3.382004 | other | Hf1Ni1Sn1 | 3 | 216 | 66.1 |
mp-1227230 | -6.726987 | -4.781479 | 5.977716 | other | Ca1Dy1Al4 | 6 | 216 | 124.19 |
mp-631424 | -5.611828 | -0.767251 | 3.284904 | other | Re1W2Br1 | 4 | 216 | 66.4 |
mp-1208937 | -8.353403 | -6.691113 | 6.880482 | other | Sm16Cd4Ir4 | 24 | 216 | 663.97 |
mp-1215908 | -8.660506 | -0.496664 | 5.025874 | other | Y1Ho1Co4 | 6 | 216 | 91.23 |
mp-631398 | 1.984998 | 2.805989 | -4.543821 | other | Te1Os1Cl2 | 4 | 216 | 74.03 |
mp-961723 | -5.946368 | -7.028197 | 3.879518 | other | Li1Ca1Rh1 | 3 | 216 | 59.87 |
mp-31441 | -8.25635 | -4.439816 | 4.2893 | other | Li2Ga1Ir1 | 4 | 216 | 52.4 |
mp-35208 | 8.546207 | 2.120463 | 2.444118 | other | Nd1O1F1 | 3 | 216 | 45.2 |
mp-631399 | 1.873219 | 2.639102 | -4.777181 | other | Os1Pt1Cl2 | 4 | 216 | 65.95 |
mp-669370 | -5.341724 | -2.126412 | 3.368788 | other | Ta20Au4S4 | 28 | 216 | 495.05 |
mp-1209278 | -5.966206 | -4.621543 | 0.928586 | other | Tb6Cu40Sb22 | 68 | 216 | 1,210.74 |
mp-7575 | 2.055693 | 2.12332 | 1.382619 | other | Li1Zn1N1 | 3 | 216 | 28.78 |
mp-1206679 | -6.606019 | -4.81545 | 0.919845 | other | Y1Bi1Pt1 | 3 | 216 | 75.44 |
mp-1213878 | -7.250693 | -5.433508 | 5.419583 | other | Ce16Cd4Ir4 | 24 | 216 | 656.59 |
mp-631539 | -5.941595 | -5.70243 | 2.350453 | other | Bi1B1Cl1 | 3 | 216 | 72.79 |
mp-631514 | -5.069095 | -6.263708 | 3.987806 | other | Al1B2Pb1 | 4 | 216 | 65.37 |
mp-1222079 | -6.801664 | -11.143902 | 5.215891 | other | Mg4Si1Sn1 | 6 | 216 | 130.37 |
mp-631520 | -5.551515 | -4.094815 | -1.330961 | other | Tl1B1Te2 | 4 | 216 | 103.81 |
mp-1222651 | -6.346153 | -6.874308 | 3.634323 | other | Li2Mg1Ge1 | 4 | 216 | 65.08 |
mp-9124 | -4.993843 | -4.991744 | 0.104553 | other | Li1Zn1As1 | 3 | 216 | 51.47 |
mp-631561 | -6.035911 | -3.699414 | 3.681301 | other | Zr1Ag1Mo1 | 3 | 216 | 64.86 |
mp-961650 | -7.561198 | -2.591239 | 4.291158 | other | Al1V1Ni1 | 3 | 216 | 46.3 |
mp-1207794 | -7.749589 | -6.564307 | 6.542283 | other | Y16Cd4Ni4 | 24 | 216 | 621.01 |
mp-11839 | -6.436169 | -4.018287 | 0.698907 | other | Gd1Sb1Pt1 | 3 | 216 | 72.81 |
mp-569703 | -8.991426 | -6.153666 | 4.767629 | other | Ce20Mg19Zn81 | 120 | 216 | 2,269.34 |
mp-10194 | -6.550585 | -3.846454 | 0.798358 | other | Lu1Sb1Pt1 | 3 | 216 | 68.13 |
mp-1018118 | -6.348398 | -4.433268 | 0.999296 | other | Tm1Sb1Pd1 | 3 | 216 | 74.94 |
mp-567435 | -6.484588 | -4.469596 | 3.273035 | other | U1Ni1Sn1 | 3 | 216 | 84.37 |
mp-1206997 | -7.622127 | -1.574184 | 4.344473 | other | Mn1Ga1Ru1 | 3 | 216 | 49.04 |
mp-674514 | -4.176105 | -1.346329 | -5.787465 | other | In5Cu1S8 | 14 | 216 | 302.39 |
mp-1222613 | -6.356111 | -7.273729 | 3.227437 | other | Li2Mg1Tl1 | 4 | 216 | 77.56 |
mp-1224259 | -5.777371 | -1.527057 | 3.724818 | other | Hf1Ti1Mo4 | 6 | 216 | 106.05 |
mp-1222606 | -5.558975 | -6.004375 | 0.602694 | other | Li2Zn1Sb1 | 4 | 216 | 76.4 |
mp-961665 | -7.755051 | -5.470792 | 5.221121 | other | Mg1Sc1Ga1 | 3 | 216 | 67.96 |
mp-999059 | -6.041502 | -2.092649 | 4.304193 | other | Ti2Ga1Fe1 | 4 | 216 | 57.08 |
mp-605835 | -7.992634 | -6.72161 | 7.000958 | other | Nd16Mg4Ru4 | 24 | 216 | 699.87 |
mp-1226553 | -7.190191 | -4.177676 | 5.87754 | other | Ce1Sc1Al4 | 6 | 216 | 118.77 |
mp-1008813 | 8.443958 | 8.560291 | -0.424367 | other | Rb1Ag1O1 | 3 | 216 | 65.02 |
mp-1077340 | -9.312031 | -1.542764 | 2.781659 | other | Ho1Ni4Au1 | 6 | 216 | 81.61 |
mp-631519 | 2.394886 | 2.899702 | -4.466858 | other | Tl1B1Cl2 | 4 | 216 | 91.69 |
mp-1226528 | -7.061001 | -4.411646 | 6.092751 | other | Ce1Y1Al4 | 6 | 216 | 126.1 |
mp-631509 | -5.549377 | -5.629981 | 4.064608 | other | Zr1Be1Cd1 | 3 | 216 | 66.43 |
mp-571107 | -8.432234 | -6.317738 | 6.247216 | other | Er16In4Rh4 | 24 | 216 | 609.42 |
mp-1227275 | -5.011289 | -1.501068 | 4.568919 | other | Be4Al1Cu1 | 6 | 216 | 56.55 |
mp-1222280 | -6.528925 | -6.814659 | 2.449507 | original | Li1In1Sn1 | 3 | 216 | 75.69 |
mp-672375 | -6.158476 | -6.049874 | 3.280666 | other | Th1Ni1Sn1 | 3 | 216 | 86.36 |
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