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-1045503 | -5.130406 | -0.827317 | -4.502023 | other | Ca2Fe4S8 | 14 | 74 | 245.77 |
mp-1097763 | 12.353265 | 9.742523 | 1.888293 | other | La4Ti4O10 | 18 | 74 | 245.01 |
mp-1226519 | -8.467665 | -3.361793 | 3.649212 | other | Ce2Ir2Pt2 | 6 | 74 | 113.35 |
mp-1222796 | 1.553651 | 2.460032 | -5.435676 | other | Li4Co2Cl8 | 14 | 74 | 266.33 |
mp-1225414 | 10.176172 | 10.503737 | 3.21188 | other | Dy4Ti4O14 | 22 | 74 | 266.24 |
mp-760594 | 12.391238 | 12.096806 | 1.77018 | other | Li2Ti4O8 | 14 | 74 | 149.96 |
mp-1224817 | 10.315072 | 9.377022 | 3.732897 | other | Gd4Zr4O14 | 22 | 74 | 298.35 |
mp-1216896 | -4.341367 | -0.72797 | -4.899986 | other | Ti2Cu2S8 | 12 | 74 | 238.78 |
mp-38683 | 6.962963 | 13.056599 | -1.849296 | other | Co4Ni2O8 | 14 | 74 | 138.02 |
mp-548805 | 11.774308 | 8.091304 | -2.022522 | other | Co4Ge2O8 | 14 | 74 | 146.17 |
mp-1216584 | -7.357052 | -0.950223 | 5.12159 | other | U2Mn2Fe2 | 6 | 74 | 94.12 |
mp-1187536 | 1.845648 | 1.830696 | 2.201671 | other | Th2Ta2N6 | 10 | 74 | 132.37 |
mp-1215934 | -7.152698 | -1.898178 | 5.973287 | other | Y2Mn2Al2 | 6 | 74 | 116.45 |
mp-1225564 | -7.785777 | 0.095338 | 5.260973 | other | Er2Fe2Ni2 | 6 | 74 | 92.39 |
mp-1869741 | -5.266487 | -0.795444 | -4.664077 | other | Li2Ni4S8 | 14 | 74 | 221.71 |
mp-673875 | -5.462205 | -0.820849 | -4.021838 | other | Fe4Rh2S8 | 14 | 74 | 219.52 |
mp-35701 | -5.426584 | -0.769525 | -3.821114 | other | Co4Rh2S8 | 14 | 74 | 216.18 |
mp-675691 | -5.492467 | -0.841161 | -3.973594 | other | Ni4Rh2S8 | 14 | 74 | 216.76 |
mp-1045335 | -4.553506 | -0.182932 | -4.8765 | other | Y2V4S8 | 14 | 74 | 293.47 |
mp-1215275 | -7.992738 | -1.282579 | 4.199996 | other | Zr2Co2Ni2 | 6 | 74 | 83.21 |
mp-33940 | 8.321157 | 11.654251 | -0.505312 | other | Mg4Pt2O8 | 14 | 74 | 155.27 |
mp-1045424 | 12.699413 | 10.130103 | 1.968269 | other | Y2Ti4O8 | 14 | 74 | 171.57 |
mp-1219661 | -7.75807 | -3.67246 | 2.774466 | other | Rb1Ge4Pt4 | 9 | 79 | 181 |
mp-29033 | 2.544749 | 2.692871 | -4.451583 | other | P3Br1Cl14 | 18 | 79 | 520.89 |
mp-690542 | 9.691251 | 12.895884 | -0.804336 | other | Li4W1O5 | 10 | 79 | 87.79 |
mp-1223845 | -5.662422 | -4.186428 | 4.625636 | other | K1Si4Pd4 | 9 | 79 | 161.71 |
mp-560748 | 3.424789 | 2.944443 | -4.162293 | other | Sb4Cl12F8 | 24 | 79 | 609.05 |
mp-28260 | 1.414391 | 2.212626 | -3.947468 | other | W1Br4O1 | 6 | 79 | 188.96 |
mp-752955 | 9.140043 | 2.982389 | -0.110409 | other | W1O1F4 | 6 | 79 | 84.02 |
mp-1208828 | 9.500459 | 2.249096 | 1.39633 | other | V8Pb8F40 | 56 | 79 | 855.8 |
mp-27754 | 2.356999 | 2.862498 | -4.280061 | other | W1Cl4O1 | 6 | 79 | 162.09 |
mp-1219656 | -5.629453 | -3.821206 | 4.543812 | other | Rb1Si4Pt4 | 9 | 79 | 165.77 |
mp-540652 | 9.354643 | 0.676526 | 0.719033 | other | Ba8Fe8F40 | 56 | 79 | 903.79 |
mp-568100 | 2.209188 | 2.793939 | -4.497663 | other | Re1N1Cl4 | 6 | 79 | 159.04 |
mp-1223832 | -5.639865 | -3.803551 | 4.498865 | other | K1Si4Pt4 | 9 | 79 | 163.16 |
mp-1209037 | 9.216542 | 1.072174 | 1.050601 | other | Sr8Cr8F40 | 56 | 79 | 814.06 |
mp-34292 | -5.90724 | -3.980773 | -2.219187 | other | Tl9Sb1Te6 | 16 | 79 | 540.1 |
mp-540653 | 8.951689 | 0.937387 | 1.42869 | other | Sr8Al8F40 | 56 | 79 | 749.88 |
mp-759591 | 11.140085 | 11.531528 | 0.720072 | other | Sr20V15O49 | 84 | 79 | 1,091.53 |
mp-675078 | -4.457895 | -1.045813 | -4.758402 | other | Ba1Fe2S4 | 7 | 79 | 150.13 |
mp-1212935 | 8.737634 | 1.341726 | 0.970659 | other | Ga8Pb8F40 | 56 | 79 | 817.37 |
mp-1214948 | 8.875135 | 1.199625 | 1.216541 | other | Al8Pb8F40 | 56 | 79 | 761.83 |
mp-1208823 | 8.76473 | 1.115734 | 1.150607 | other | Sr8Ga8F40 | 56 | 79 | 801.02 |
mp-675020 | 9.098573 | 12.816161 | -1.251672 | other | Li4Mo1O5 | 10 | 79 | 87.58 |
mp-1245410 | 0.809514 | 2.718658 | 1.861218 | other | Li12W8N20 | 40 | 80 | 557.04 |
mp-1440576 | 10.547788 | 10.767107 | 3.219274 | other | Dy2Nb2O8 | 12 | 80 | 153.45 |
mp-1029857 | 1.05233 | 2.652234 | 1.585649 | other | Rb12W8N20 | 40 | 80 | 884.74 |
mp-1119092 | 1.042427 | 2.672905 | 1.576367 | other | Cs12W8N20 | 40 | 80 | 969.31 |
mp-1246353 | 0.914529 | 2.442494 | 1.76318 | other | Na12Re8N20 | 40 | 80 | 687.8 |
mp-505145 | 9.215769 | 8.657376 | -1.097818 | other | Ag24Bi8O24 | 56 | 80 | 931.89 |
mp-1029565 | 0.833772 | 2.709721 | 1.711498 | other | Na12W8N20 | 40 | 80 | 650.72 |
mp-778604 | 9.860685 | 10.225642 | 0.137071 | other | Li24Bi8O24 | 56 | 80 | 737.09 |
mp-1245865 | 1.022562 | 2.383218 | 1.448474 | other | Cs10Ir10N20 | 40 | 80 | 791.2 |
mp-1300570 | 11.505279 | 10.995471 | -2.230694 | other | Ba2W2O8 | 12 | 80 | 212.62 |
mp-1247239 | 0.984163 | 2.710982 | 1.602158 | other | Cs12Mo8N20 | 40 | 80 | 956.27 |
mp-1118943 | 1.028508 | 2.35529 | 1.763235 | other | Cs12Re8N20 | 40 | 80 | 977.39 |
mp-29532 | 9.117393 | 10.951159 | 0.820802 | other | Ca22Re8O48 | 78 | 80 | 1,030.16 |
mp-1029845 | 0.821709 | 2.722738 | 1.753344 | other | Na12Mo8N20 | 40 | 80 | 641.31 |
mp-1029938 | 1.012152 | 2.670259 | 1.631217 | other | K12W8N20 | 40 | 80 | 812.97 |
mp-559065 | 7.526101 | 6.473495 | -2.915116 | other | Na2I6O16 | 24 | 81 | 374.79 |
mp-675741 | -2.553347 | -2.763123 | -5.156912 | other | La10U1S16 | 27 | 81 | 652.16 |
mp-1191012 | 5.454533 | -0.459751 | -3.061981 | other | Ca2B4H16 | 22 | 81 | 212.73 |
mp-1048044 | 5.64439 | 11.187881 | -1.890323 | other | Zn2Fe8O18 | 28 | 81 | 366.74 |
mp-29536 | 8.421763 | 1.29555 | 0.000732 | other | Ag20C4F16 | 40 | 81 | 604.56 |
mp-1173113 | -4.081053 | -4.290076 | -3.638249 | other | Tb10Yb1Se16 | 27 | 81 | 666.21 |
mp-676880 | -2.869396 | -2.916568 | -4.494102 | other | Ce10U1S16 | 27 | 81 | 609.95 |
mp-552966 | 8.258287 | 4.348122 | -6.528948 | other | Rb4C1O4 | 9 | 81 | 217.76 |
mp-2229066 | 11.751227 | 11.298977 | -2.177111 | other | Mg1W4O12 | 17 | 81 | 226.37 |
mp-1235526 | 10.090577 | 13.821237 | -0.95799 | other | Li1Cr2O4 | 7 | 81 | 67.01 |
mp-675336 | -2.594969 | -2.836364 | -5.258631 | other | Pr10U1S16 | 27 | 81 | 640.31 |
mp-2215960 | 11.303861 | 13.035077 | -0.41405 | other | Mg1Cr2O4 | 7 | 81 | 75.98 |
mp-2225552 | 12.872477 | 10.946053 | 1.742717 | other | Mg1Ti2O4 | 7 | 81 | 77.95 |
mp-685926 | -2.699318 | -2.841727 | -5.214666 | other | Nd10U1S16 | 27 | 81 | 627.35 |
mp-672676 | -4.577797 | 0.186971 | 3.029785 | other | U2W8C8 | 18 | 83 | 221.87 |
mp-1256151 | -6.722679 | -3.404558 | 4.030546 | other | Zr10Al2Ni8 | 20 | 83 | 347.27 |
mp-1225232 | -7.082559 | 0.822314 | 3.987674 | other | Ga1Fe19N5 | 25 | 83 | 265.25 |
mp-554231 | 7.681364 | 10.074185 | 1.685246 | other | Nd5Cu5O13 | 23 | 83 | 275.53 |
mp-686086 | -5.912504 | -3.984584 | -2.194947 | other | Tl54Sb6Te36 | 96 | 83 | 3,284 |
mp-1224295 | -5.017624 | -0.682466 | 3.300986 | other | Hf1Ta5B4 | 10 | 83 | 129.95 |
mp-1191537 | -7.536456 | -5.4338 | 3.353379 | other | Yb7Ni4Sn13 | 24 | 83 | 575.99 |
mp-1222504 | -5.889643 | 0.038022 | 3.508311 | other | Mn12Ge4N3 | 19 | 83 | 245.62 |
mp-1189752 | -4.57022 | 0.185517 | 3.028764 | other | U2W8C8 | 18 | 83 | 221.71 |
mp-1079262 | 3.018499 | 3.035962 | -3.952697 | other | Pt2N4Cl4 | 10 | 83 | 336.73 |
mp-761128 | 13.041815 | 10.416281 | 2.319178 | original | Ba1Nb5O8 | 14 | 83 | 184.87 |
mp-1224366 | -5.258313 | -3.497885 | 4.755384 | other | Hf5Sc1Si4 | 10 | 83 | 183.29 |
mp-1045120 | 12.902703 | 10.635496 | -0.30598 | other | Zn1W4O9 | 14 | 83 | 185.78 |
mp-1279320 | 7.9329 | 11.737646 | 2.244307 | other | La4Mn4O12 | 20 | 83 | 248.18 |
mp-1003635 | 8.222561 | 14.387825 | -1.610735 | other | Na1Mn16O32 | 49 | 83 | 542.73 |
mp-1080221 | 8.286352 | 14.296368 | -1.627527 | other | K1Mn16O32 | 49 | 83 | 578.83 |
mp-603888 | 7.242959 | 11.995417 | 1.768399 | other | Sr5Mn5O13 | 23 | 83 | 284.43 |
mp-685386 | 7.569193 | 10.87395 | 0.915629 | other | Sr24Ru21O72 | 117 | 83 | 1,511.87 |
mp-31158 | -6.908113 | -5.903121 | 2.99153 | other | Ca7Ni4Sn13 | 24 | 83 | 578.22 |
mp-1223730 | 10.039124 | 0.809345 | 1.443152 | other | K5Fe10F30 | 45 | 83 | 660.71 |
mp-1226400 | -7.149564 | -5.759345 | 2.290253 | other | Cr2Sn9Au1 | 12 | 83 | 313.09 |
mp-1025331 | -4.806083 | -2.773401 | -3.980319 | other | In2Ag1Se4 | 7 | 82 | 208.33 |
mp-1221916 | 11.573887 | 12.81371 | -2.794108 | other | Mn9V6O24 | 39 | 82 | 469.34 |
mp-1207863 | 10.482356 | 11.593656 | -3.440967 | other | V1Ag4O4 | 9 | 82 | 141.5 |
mp-626379 | 10.297546 | 6.189931 | -4.207974 | other | Fe4H4O8 | 16 | 82 | 151.24 |
mp-7909 | -6.091614 | -3.429159 | -2.172215 | other | Al2Cd1Te4 | 7 | 82 | 231.64 |
mp-29201 | 8.504592 | 1.392278 | 0.061543 | other | Tb1Cd2F8 | 11 | 82 | 163.9 |
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