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-35795 | 8.444347 | 1.530657 | 0.942203 | other | Bi1Pb1F5 | 7 | 1 | 111.52 |
mp-1182020 | 10.397044 | 3.767991 | -4.148761 | other | Ca2H32O20 | 54 | 1 | 469.53 |
mp-722212 | 7.540871 | 4.967841 | -1.680217 | other | Zr16N16O8 | 40 | 1 | 538.12 |
mp-758400 | 9.417567 | 13.846611 | -0.789406 | other | Mn10Fe8O24 | 42 | 1 | 487.48 |
mp-763215 | 9.711556 | 1.014457 | -0.529468 | other | Ni6O2F10 | 18 | 1 | 204.25 |
mp-759522 | 15.27823 | 12.384648 | -0.875412 | other | V6O7F5 | 18 | 1 | 203.19 |
mp-1100938 | 12.594978 | 12.488412 | -1.361248 | other | V6Ga3O15 | 24 | 1 | 305.94 |
mp-1172980 | 8.828201 | 12.40956 | -0.213957 | other | Li34Co6O24 | 64 | 1 | 610.78 |
mp-752906 | 6.051171 | 8.509593 | -0.744231 | other | Ba4Pb3O10 | 17 | 1 | 295.54 |
mp-1042254 | 11.133827 | 9.569125 | 0.234645 | other | Zn2Sn4O8 | 14 | 1 | 199.54 |
mp-625964 | 8.322482 | 5.166973 | -3.998937 | other | Ba2H8O12 | 22 | 1 | 256.78 |
mp-1225022 | -6.602683 | -0.555427 | 2.158719 | other | Fe7Ni5P4 | 16 | 1 | 177.89 |
mp-705676 | 7.513681 | 5.905449 | -3.513725 | other | K4Mo1O8 | 13 | 1 | 258.8 |
mp-1246864 | 1.851024 | 2.231207 | 1.391712 | other | Zn16Cu4N12 | 32 | 1 | 475.96 |
mp-753244 | 10.147185 | 0.681683 | -0.223361 | other | Li2Mn4F18 | 24 | 1 | 350.03 |
mp-773043 | 5.966797 | 12.364824 | -1.613658 | other | Li8Fe16O32 | 56 | 1 | 575.25 |
mp-849479 | 12.711726 | -0.037337 | -0.067137 | other | Mn12O14F10 | 36 | 1 | 401.45 |
mp-754652 | 10.666987 | 12.616091 | -4.647707 | original | V4O7F5 | 16 | 1 | 208.92 |
mp-1100865 | 7.755417 | 9.172256 | -1.139381 | other | Yb10Ti6O27 | 43 | 1 | 548.16 |
mp-849478 | 12.82385 | -1.147027 | 0.702475 | other | Mn12O10F14 | 36 | 1 | 422.18 |
mp-626502 | 11.729518 | 4.185861 | -3.773982 | other | Al8H24O24 | 56 | 1 | 432.34 |
mp-760972 | 12.430981 | -1.042474 | 0.967296 | other | Mn6O4F8 | 18 | 1 | 219.77 |
mp-677065 | 8.657362 | 2.174191 | 0.652424 | other | Ta5O5F15 | 25 | 1 | 331.1 |
mp-690516 | 6.779131 | 10.974293 | 0.221144 | other | Sr2Co2O5 | 9 | 1 | 130.91 |
mp-1104866 | 7.973343 | 8.946812 | -3.854772 | other | Mg1Re2O12 | 15 | 1 | 286.66 |
mp-849466 | 8.594662 | 15.118068 | -1.680035 | other | Mn6O10F2 | 18 | 1 | 187.16 |
mp-1100997 | -6.396845 | -2.739048 | -1.791877 | other | Tl1Cr5Te8 | 14 | 1 | 384.75 |
mp-675329 | 10.45179 | 9.947527 | 4.013946 | other | La1Zr9O20 | 30 | 1 | 362.51 |
mp-626271 | 10.457537 | 3.729054 | -4.10497 | other | Sr2H32O20 | 54 | 1 | 453.47 |
mp-1235106 | 6.730214 | 12.597317 | -1.44384 | other | Li1Ni9O13 | 23 | 1 | 230.24 |
mp-1390750 | 8.675161 | 4.13733 | -1.148677 | other | Cr4O1F11 | 16 | 1 | 198.67 |
mp-626755 | 10.847038 | 3.966739 | -3.939238 | other | Sr2H8O6 | 16 | 1 | 155.55 |
mp-755158 | 9.934491 | 14.958195 | -1.438537 | other | Mn6O8F4 | 18 | 1 | 196.3 |
mp-1216324 | -2.906461 | -2.383634 | -5.999376 | other | Y12Si5S28 | 45 | 1 | 956.78 |
mp-1248478 | 7.379183 | 12.827461 | -1.969859 | other | Al6Co6O18 | 30 | 1 | 300.84 |
mp-777342 | 12.197993 | 3.148096 | 1.004642 | other | V8O6F18 | 32 | 1 | 393.35 |
mp-1173344 | 6.428922 | 5.532143 | -4.38852 | other | Rb4N2O7 | 13 | 1 | 299.43 |
mp-1340868 | 7.450526 | 5.011608 | -1.820651 | other | In4H12O12 | 28 | 1 | 266.2 |
mp-1235283 | 14.599501 | 6.393845 | -0.375945 | other | Li1Si6O12 | 19 | 1 | 260.69 |
mp-697853 | 10.335828 | 10.656817 | 1.091341 | other | Ba6W2O12 | 20 | 1 | 367.41 |
mp-627114 | 13.349821 | 7.646429 | -1.22923 | other | Si20H20O30 | 70 | 1 | 961.39 |
mp-531553 | 2.186994 | 2.272805 | 1.519686 | other | Li80Ge16N48 | 144 | 1 | 1,350.46 |
mp-1354978 | 7.529546 | 4.732742 | -1.732913 | other | Zr16N16O8 | 40 | 1 | 538.12 |
mp-1275776 | 7.643788 | 12.275871 | 1.615499 | other | Ca4Mn4O10 | 18 | 1 | 230.55 |
mp-755178 | 12.437783 | -1.046756 | 0.963035 | other | Mn6O4F8 | 18 | 1 | 219.37 |
mp-772038 | 11.314506 | 11.83273 | 2.626522 | other | Nb18P3O50 | 71 | 1 | 1,013.85 |
mp-764879 | 12.192292 | 3.141329 | 1.0128 | other | V8O6F18 | 32 | 1 | 394.83 |
mp-778369 | 10.239301 | 2.44183 | 0.079819 | other | V6O2F22 | 30 | 1 | 417.25 |
mp-756006 | -3.5857 | -1.820494 | -4.694331 | other | Li2Sb2S2 | 6 | 1 | 144.37 |
mp-1042578 | 12.881786 | 10.332605 | 0.271392 | other | Zn2W4O8 | 14 | 1 | 188.77 |
mp-757982 | 11.11786 | 4.086463 | -4.19097 | other | In4H12O12 | 28 | 1 | 266.2 |
mp-1244976 | 10.750527 | 12.778051 | -1.07043 | other | Cr24Fe8O48 | 80 | 1 | 1,022.26 |
mp-764770 | 9.415148 | 12.313125 | -0.007622 | other | Li26Mn4O18 | 48 | 1 | 469.86 |
mp-1221501 | -6.066272 | 1.497841 | -4.456334 | other | Mo6Se4S4 | 14 | 1 | 285.28 |
mp-675751 | 11.061595 | 9.76405 | 4.316198 | other | Zr14N4O22 | 40 | 1 | 487.27 |
mp-685437 | 3.253665 | -0.83921 | -2.168406 | other | Ca22H51Rh11 | 84 | 1 | 1,043.41 |
mp-675033 | -6.033751 | -3.393467 | -2.262183 | other | Ga12Ag2Te19 | 33 | 1 | 1,154.73 |
mp-690531 | 6.902889 | 11.75021 | 1.617063 | other | La5Mn5O18 | 28 | 1 | 345.51 |
mp-776212 | 1.683068 | 1.806446 | 2.940133 | other | Hf16N16O8 | 40 | 1 | 502.47 |
mp-1201512 | 5.414352 | -0.455286 | -3.012263 | other | Mg4B8H31 | 43 | 1 | 693.94 |
mp-673706 | -7.217831 | 1.624778 | -4.318836 | other | Li7Mo12Se16 | 35 | 1 | 674.52 |
mp-775783 | 1.680161 | 1.805013 | 2.943894 | other | Hf16N16O8 | 40 | 1 | 502.46 |
mp-685906 | -6.035152 | -3.380962 | -2.250741 | other | Li7Ga24Te40 | 71 | 1 | 2,236.3 |
mp-675428 | 6.367833 | 11.425556 | 0.316295 | other | Sr24Ni19O54 | 97 | 1 | 1,244.41 |
mp-1640981 | 7.033409 | 19.580759 | -0.193732 | other | Li7Mn5O12 | 24 | 1 | 221.91 |
mp-2227385 | 6.601576 | 13.335378 | -1.988025 | other | Mg1Co4O8 | 13 | 1 | 147.23 |
mp-764428 | 8.448843 | 13.628392 | -0.909253 | other | Li12Cr5O16 | 33 | 1 | 285.48 |
mp-684014 | -6.609014 | -4.412066 | 1.100426 | other | Sn14Sb11Pt8 | 33 | 1 | 846.75 |
mp-1233212 | 13.887567 | 6.822525 | -0.820832 | other | Ca1Si6O12 | 19 | 1 | 265.34 |
mp-757372 | 11.079743 | 9.080735 | 2.009822 | other | Sr5U5O19 | 29 | 1 | 423.38 |
mp-867022 | -3.402109 | -1.658542 | -5.624899 | other | Ca6Sn6S18 | 30 | 1 | 883.99 |
mp-1100869 | 7.931918 | 8.870448 | -0.956336 | other | Yb7Bi17O36 | 60 | 1 | 1,046.09 |
mp-676910 | -6.903322 | 1.430829 | -4.202162 | other | Mg3Mo12Se16 | 31 | 1 | 667.87 |
mp-755229 | 12.160625 | 3.127255 | 1.005987 | other | V4O3F9 | 16 | 1 | 199.44 |
mp-674502 | 8.950643 | 10.510468 | -1.182594 | other | Co5Bi8O20 | 33 | 1 | 491.07 |
mp-770778 | 12.398008 | 12.686217 | -0.597467 | other | V4Cr4O12 | 20 | 1 | 199.09 |
mp-773080 | 12.090749 | 11.956176 | -2.148079 | other | V7W6O30 | 43 | 1 | 549.48 |
mp-753003 | 7.702522 | 6.425399 | -1.54152 | other | Fe8O10F6 | 24 | 1 | 272.58 |
mp-1173830 | -4.591729 | -5.653196 | 0.451889 | other | Na24Ga4As12 | 40 | 1 | 983.67 |
mp-1334909 | -4.052649 | -4.26631 | -3.728891 | other | Tb24Pb4Se40 | 68 | 1 | 1,712.61 |
mp-1182698 | 10.657096 | 5.787191 | -4.298877 | other | Fe16H20O34 | 70 | 1 | 684.29 |
mp-778467 | 12.811107 | 0.879474 | 2.20276 | other | Fe10O6F14 | 30 | 1 | 360.76 |
mp-1639930 | 7.027876 | 19.590553 | -0.187975 | other | Li14Mn10O24 | 48 | 1 | 442.54 |
mp-1182738 | -4.016962 | -5.373624 | 5.308512 | other | Ba8Cu1Si16 | 25 | 1 | 726.05 |
mp-626570 | 10.377516 | 6.116657 | -4.376229 | other | Fe16H16O32 | 64 | 1 | 733.51 |
mp-675060 | -5.188988 | -2.809431 | -4.147666 | other | In8Cu7Se16 | 31 | 1 | 754.62 |
mp-703429 | 9.366973 | 8.552586 | 3.176682 | other | Ba3Y4O9 | 16 | 1 | 281.62 |
mp-1179374 | 10.396701 | 3.696111 | -4.09339 | other | Sr1H16O10 | 27 | 1 | 280.85 |
mp-675075 | 8.622056 | 15.127718 | -0.730438 | other | Li7Mn10O20 | 37 | 1 | 385.16 |
mp-530524 | 8.578636 | 1.557389 | 0.765484 | other | Zr12Tl4F60 | 76 | 1 | 1,018.07 |
mp-691187 | -2.653726 | -2.666883 | -5.731612 | other | Li2Pr2S4 | 8 | 1 | 185.3 |
mp-1178251 | 11.226861 | 0.697957 | 1.318893 | other | Fe5O1F11 | 17 | 1 | 225.05 |
mp-752587 | 10.275679 | 1.332168 | -1.719655 | other | Co6O5F7 | 18 | 1 | 199.26 |
mp-849551 | 11.788271 | -0.500779 | 1.205096 | other | Mn12O5F19 | 36 | 1 | 456.7 |
mp-2224735 | 12.612038 | 13.114699 | -1.33268 | other | Mg1V5O10 | 16 | 1 | 185.45 |
mp-2219790 | -5.409141 | -0.727932 | -4.027406 | other | Mg1Co4S8 | 13 | 1 | 213.57 |
mp-780974 | 12.724063 | 0.476265 | 0.243531 | other | Fe10O11F9 | 30 | 1 | 344.25 |
mp-657176 | 8.548606 | 1.245501 | 1.062085 | other | Yb4Be4F16 | 24 | 1 | 330.8 |
mp-759893 | 12.321101 | -0.844663 | 0.892342 | other | Mn12O7F17 | 36 | 1 | 437.22 |
mp-755093 | 14.355601 | 12.843778 | -1.311271 | other | V8O12F4 | 24 | 1 | 266.34 |
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