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-27544 | -0.49574 | 1.278393 | -4.699607 | other | Cs3Bi2Br9 | 14 | 164 | 553.13 |
mp-548598 | 10.560397 | 9.641963 | 0.908563 | other | U1Bi2O6 | 9 | 164 | 124.25 |
mp-1246454 | 0.771529 | 2.527639 | 1.975138 | other | Cr2S1N2 | 5 | 164 | 56.43 |
mp-6953 | -4.320832 | -3.151615 | 0.881095 | other | Ca1Mn2P2 | 5 | 164 | 84.57 |
mp-8191 | 8.313203 | 0.859039 | 0.347201 | other | Cs2Pt1F6 | 9 | 164 | 167.22 |
mp-1224830 | -5.822801 | -3.303214 | -2.119208 | other | Ga2Ge2Te4 | 8 | 164 | 266.54 |
mp-1221364 | -6.283813 | -2.276099 | -1.065434 | other | Mn1Ni1Te2 | 4 | 164 | 80.74 |
mp-29209 | -5.780496 | -6.259211 | 0.739914 | other | Ba1Mg2Bi2 | 5 | 164 | 173.14 |
mp-4764 | 10.569652 | 7.885712 | 2.702752 | other | Pr2Se1O2 | 5 | 164 | 100.38 |
mp-1208387 | -7.433631 | -4.915008 | 3.120656 | other | Tb7Co6Sn23 | 36 | 164 | 801.95 |
mp-8277 | -3.448208 | -4.400246 | 0.848294 | other | Sr1Cd2P2 | 5 | 164 | 120.34 |
mp-643047 | 3.246386 | -0.807542 | -2.320405 | other | Ba3H12Ir2 | 17 | 164 | 233.95 |
mp-1215929 | -6.658026 | -4.619912 | 6.070086 | other | Y2Mg2Al8 | 12 | 164 | 235.26 |
mp-1147656 | -5.172459 | -5.759388 | 0.64007 | other | Ca1Al2Sb2 | 5 | 164 | 129.88 |
mp-1045019 | 13.047198 | 12.729183 | -0.68262 | other | Al4V12O24 | 40 | 164 | 450.18 |
mp-1217994 | -3.889814 | -0.253968 | -3.696381 | other | Ta2Zn1S4 | 7 | 164 | 125.54 |
mp-1091363 | 8.834475 | 1.829924 | 1.117744 | other | K2Tc1F6 | 9 | 164 | 131.75 |
mp-1097028 | -4.264371 | -3.960462 | -3.888355 | other | Gd1Ag1Se2 | 4 | 164 | 97.78 |
mp-1017630 | -4.879365 | -5.067245 | 0.156974 | other | Mg2Zn1As2 | 5 | 164 | 105.13 |
mp-1030709 | -8.922231 | 2.653903 | -3.996181 | other | Te4Mo4Se4 | 12 | 164 | 400.61 |
mp-1245404 | 0.68448 | 2.473334 | 1.980637 | other | Cr2Se1N2 | 5 | 164 | 60.07 |
mp-1219107 | -8.181664 | -6.571396 | 5.128197 | other | Sm2Cd2In2 | 6 | 164 | 156.78 |
mp-572797 | 8.323144 | 0.883329 | 0.414889 | other | Cs2Ir1F6 | 9 | 164 | 167.27 |
mp-1219016 | -4.475009 | -3.040333 | -4.064649 | other | Sn2Pb1Se3 | 6 | 164 | 168.29 |
mp-7708 | -3.904525 | -1.674445 | -5.610923 | other | Tl1Cd1S2 | 4 | 164 | 93.71 |
mp-1227461 | -8.474834 | -0.200456 | 4.436185 | other | Ce4Ti2Co32 | 38 | 164 | 490.75 |
mp-706269 | 12.583975 | 10.023062 | 2.060994 | other | Mg1Nb5O9 | 15 | 164 | 187.7 |
mp-754868 | 11.39115 | 12.102648 | 0.272001 | other | Li8Fe4O8 | 20 | 164 | 185.03 |
mp-504554 | 9.952347 | 10.717859 | 3.43101 | other | Ba5Ta4O15 | 24 | 164 | 348.6 |
mp-1211475 | -6.612934 | -2.355708 | 6.38724 | other | La4Al51W7 | 62 | 164 | 1,115.63 |
mp-3970 | 8.73052 | 1.201936 | 1.179219 | other | K2Ti1F6 | 9 | 164 | 128.48 |
mp-1217394 | -5.540979 | -1.299562 | 4.261362 | other | Th2U2Re8 | 12 | 164 | 228.16 |
mp-1103290 | 5.327451 | -0.461595 | -2.911085 | other | Mg1B2H8 | 11 | 164 | 85.01 |
mp-5381 | 1.688435 | 1.61269 | 2.278129 | other | U2P1N2 | 5 | 164 | 82.44 |
mp-1224005 | -5.897906 | -3.608439 | -2.27653 | other | In3Sb1Te2 | 6 | 164 | 182.66 |
mp-1222508 | -4.65989 | -1.506232 | -5.771307 | other | Lu2Cu6S6 | 14 | 164 | 249.34 |
mp-1226009 | -6.434781 | -1.954141 | 1.02093 | other | Co1Ni1As2 | 4 | 164 | 56.52 |
mp-1245477 | 0.374768 | 2.458033 | 1.964351 | other | Mn2Ni1N2 | 5 | 164 | 47.08 |
mp-1018761 | -5.523513 | -5.420037 | 0.720498 | other | Li3Ce1Sb2 | 6 | 164 | 136.73 |
mp-1236294 | 11.81675 | 9.01518 | 2.012729 | other | Li1Ce2O3 | 6 | 164 | 84.49 |
mp-8407 | -3.60713 | -4.098099 | 0.909429 | other | Li3La1P2 | 6 | 164 | 106.54 |
mp-1216678 | -5.512846 | -1.216611 | 2.274698 | other | Ti1Mo1P2 | 4 | 164 | 59.27 |
mp-1018634 | -4.439215 | -1.543332 | -5.762393 | other | Lu1Cu2S2 | 5 | 164 | 81.22 |
mp-1226013 | -5.571474 | -1.595868 | -3.224735 | other | Co1Ni1Se2 | 4 | 164 | 59.82 |
mp-1217475 | -5.517567 | -1.292821 | 4.075097 | other | Tb2Th2Re8 | 12 | 164 | 233.8 |
mp-7903 | 8.281628 | 0.967248 | 1.480243 | other | Cs2Zr1F6 | 9 | 164 | 175.31 |
mp-1026916 | -5.812155 | 1.749966 | -4.596258 | other | Mo4Se4S4 | 12 | 164 | 324.84 |
mp-1210058 | -6.3504 | -1.242787 | 1.084291 | other | Ni30Sb3P9 | 42 | 164 | 490.08 |
mp-2217389 | -3.956823 | -0.258074 | -4.576099 | other | Mg1Ti3S6 | 10 | 164 | 222.66 |
mp-1292002 | 10.75827 | 4.603117 | -4.178461 | other | Co4H8O8 | 20 | 164 | 169.83 |
mp-1206602 | -6.230306 | -5.164537 | 5.153694 | other | Tm1Al2Ge2 | 5 | 164 | 100.61 |
mp-8152 | -5.161865 | -4.573438 | 0.673459 | other | Li2Ce1As2 | 5 | 164 | 107.48 |
mp-1211238 | -1.021577 | 1.014144 | -1.606432 | other | La2Sb1I2 | 5 | 164 | 204.09 |
mp-1017567 | 1.787801 | 1.751258 | 2.539159 | other | Hf2S1N2 | 5 | 164 | 70.61 |
mp-974482 | 10.201994 | 9.899861 | 3.851068 | other | K4Hf5O12 | 21 | 164 | 297.24 |
mp-1221754 | -5.559838 | -1.497815 | -3.407539 | other | Mn1Co1Se2 | 4 | 164 | 58.8 |
mp-1101094 | 1.298844 | 2.375742 | -5.940366 | other | Cs2Ce1Cl6 | 9 | 164 | 299.07 |
mp-6931 | -4.071183 | -5.17566 | 5.892532 | other | Sr1Al2Si2 | 5 | 164 | 113.13 |
mp-8276 | -3.272171 | -4.155967 | 0.789312 | other | Sr1Zn2P2 | 5 | 164 | 102.37 |
mp-1224427 | -7.005495 | -0.085204 | 4.624646 | other | Hf2Ta2Fe8 | 12 | 164 | 162.89 |
mp-30243 | 15.970103 | 8.212932 | 3.596372 | other | Mg6H4O8 | 18 | 164 | 152.71 |
mp-1206452 | -0.227591 | 0.522063 | -2.991716 | other | Gd2Ge1Br2 | 5 | 164 | 153.34 |
mp-1025350 | -4.225795 | -0.336136 | -3.780509 | other | Nb2Co1S4 | 7 | 164 | 125.24 |
mp-1220045 | -5.914512 | -0.347671 | 3.543305 | other | Os3W3C2 | 8 | 164 | 104.57 |
mp-13069 | -6.354597 | -5.016456 | 5.112356 | other | Er1Al2Ge2 | 5 | 164 | 101.37 |
mp-1208228 | -5.728613 | -2.682492 | 4.190198 | other | Ti3Nb1Al2 | 6 | 164 | 99.52 |
mp-3216 | 1.841727 | 1.965423 | 2.039582 | other | Li2Zr1N2 | 5 | 164 | 50.57 |
mp-29624 | -4.853646 | -3.249337 | -4.037951 | other | Mg2Al2Se5 | 9 | 164 | 213.78 |
mp-4836 | -5.787523 | -4.875111 | 0.728788 | other | Yb1Mn2Sb2 | 5 | 164 | 130.29 |
mp-1206156 | 7.944318 | 2.216256 | -1.153436 | other | Pb1N2F6 | 9 | 164 | 137.19 |
mp-8651 | -4.357109 | -4.767226 | 6.064068 | other | Gd1Al2Si2 | 5 | 164 | 101.26 |
mp-1207067 | 8.077635 | 2.524648 | -1.33592 | other | S1N2F6 | 9 | 164 | 146.03 |
mp-3972 | 11.105509 | 7.944772 | 2.856942 | other | Ce2S1O2 | 5 | 164 | 94.27 |
mp-1245879 | 0.075022 | 2.428002 | 2.101521 | other | Mn2Fe1N2 | 5 | 164 | 46.97 |
mp-8406 | -5.212504 | -4.77896 | 0.566801 | other | Li3Nd1As2 | 6 | 164 | 110.8 |
mp-8405 | -5.510288 | -5.564489 | 0.727837 | other | Li3La1Sb2 | 6 | 164 | 139.23 |
mp-644229 | 3.368953 | -0.712141 | -2.156609 | other | Sr1Al2H2 | 5 | 164 | 84.04 |
mp-1219724 | -8.152114 | -6.514679 | 5.041117 | other | Pr2Cd2In2 | 6 | 164 | 164.6 |
mp-1028604 | -9.249214 | 2.874468 | -4.803396 | other | Te4W4S4 | 12 | 164 | 375.2 |
mp-1221940 | -5.572071 | -1.636358 | -3.50873 | other | Mn2Fe1Se3 | 6 | 164 | 92.2 |
mp-1221348 | -5.648742 | -1.535473 | -3.297172 | other | Mn1Ni1Se2 | 4 | 164 | 61.07 |
mp-652550 | -5.144384 | -4.419112 | 6.057025 | other | Er90Si54C18 | 162 | 164 | 3,484.35 |
mp-553875 | 1.777031 | 1.740449 | 2.65836 | other | Zr2S1N2 | 5 | 164 | 73.06 |
mp-1245625 | 2.112394 | 2.119691 | 1.541815 | other | Mg1Zn2N2 | 5 | 164 | 54.47 |
mp-1216773 | -8.590178 | -0.510842 | 2.489215 | other | Zr8Ni61B18 | 87 | 164 | 907.72 |
mp-1210585 | -5.542078 | -5.728306 | 0.478146 | other | Mg1Zn2Sb2 | 5 | 164 | 117.62 |
mp-1206548 | -4.222298 | -0.32053 | -3.915965 | other | Nb2Ni1S4 | 7 | 164 | 137.43 |
mp-1222408 | -7.985232 | -5.693297 | 3.505923 | other | Lu2Cu2Sn2 | 6 | 164 | 133.56 |
mp-5745 | -2.867116 | 0.404602 | -0.133744 | other | Nb2C1S2 | 5 | 164 | 87.45 |
mp-19088 | 11.874507 | 10.976465 | 0.582156 | other | Ba5V5O14 | 24 | 164 | 368.35 |
mp-1192831 | -4.871879 | -1.633795 | -3.144507 | other | Ti8Fe4Se16 | 28 | 164 | 543.51 |
mp-1217903 | -4.465795 | -0.04174 | 2.993204 | other | Ta1Mo2C3 | 6 | 164 | 64.66 |
mp-1211706 | 8.542212 | 6.862506 | -3.712502 | other | K3Se2O8 | 13 | 164 | 290.06 |
mp-10581 | -6.419375 | -5.084398 | 5.330084 | other | Nd1Al2Ge2 | 5 | 164 | 108.33 |
mp-568694 | -0.321136 | 0.793993 | -3.92581 | other | Na6U3Br18 | 27 | 164 | 886.8 |
mp-756137 | 13.040769 | 10.993078 | 2.207792 | other | Li3Nb6O11 | 20 | 164 | 240.36 |
mp-1216903 | -4.999779 | -0.541777 | -4.771094 | other | Ti1Cr1S2 | 4 | 164 | 60.76 |
mp-1207012 | -6.286787 | -5.167902 | 5.196539 | other | Ho1Al2Ge2 | 5 | 164 | 102.01 |
mp-8483 | 9.940493 | 4.634862 | -6.10034 | other | K4S2O6 | 12 | 164 | 224.54 |
mp-2365577 | -5.445592 | -0.839178 | -4.572176 | other | Li2Ni2S4 | 8 | 164 | 117.64 |
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