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-1178963 | 9.366928 | 2.858891 | 1.326239 | other | Ti1F3 | 4 | 166 | 46.29 |
mp-8628 | -6.218099 | -2.696169 | -0.991564 | other | Te4Pt3 | 7 | 166 | 171.04 |
mp-557762 | -3.936413 | -0.589406 | -3.745929 | other | Ti3S3 | 6 | 166 | 91.47 |
mp-2584 | -7.783926 | 0.287058 | 5.762511 | other | Tb3Fe9 | 12 | 166 | 188.19 |
mp-1216560 | -5.962367 | -7.008852 | 1.730592 | other | Tl4Sn1 | 5 | 166 | 147.63 |
mp-1077925 | -5.837136 | -7.050547 | 2.715556 | other | Na5Sn2 | 7 | 166 | 187.42 |
mp-1105572 | -8.692794 | -0.141037 | 4.448781 | other | Ce2Co17 | 19 | 166 | 245.33 |
mp-1430160 | -5.06756 | -0.583857 | -4.188565 | other | Fe1S2 | 3 | 166 | 64.06 |
mp-1225722 | -8.6622 | -4.731256 | 3.195012 | other | Cu5Ge2 | 7 | 166 | 98.53 |
mp-550206 | 6.201132 | 13.758779 | -2.516312 | other | Co1O2 | 3 | 166 | 55.87 |
mp-1640 | -7.430662 | -6.531252 | 6.594288 | other | Ho2C1 | 3 | 166 | 66.93 |
mp-1102468 | -8.239586 | -0.855499 | 4.85421 | other | U3Co9 | 12 | 166 | 161.7 |
mp-16932 | -8.667332 | -0.181203 | 4.427335 | other | Th2Co17 | 19 | 166 | 243.54 |
mp-1226077 | -8.64747 | -5.561058 | 2.190633 | other | Co1Au4 | 5 | 166 | 85.29 |
mp-622633 | -6.334496 | -1.960765 | 3.979666 | other | Nb6Co7 | 13 | 166 | 222.05 |
mp-23229 | 1.366365 | 2.421417 | -5.223538 | other | Fe1Cl2 | 3 | 166 | 65.6 |
mp-7851 | -7.132069 | -0.593111 | 3.718787 | other | Ta3Co9 | 12 | 166 | 140.06 |
mp-1334 | -7.155783 | -6.409307 | 6.415348 | other | Y2C1 | 3 | 166 | 69.43 |
mp-1106043 | -8.867922 | -0.268707 | 4.815578 | other | Sm4Co14 | 18 | 166 | 260.54 |
mp-1223656 | -8.105354 | -4.098029 | 2.943084 | other | In1Pt1 | 2 | 166 | 37.55 |
mp-1103958 | -8.658467 | -2.625286 | 4.010976 | other | Gd3Ir9 | 12 | 166 | 216.86 |
mp-561488 | 14.695875 | 6.17499 | -0.418773 | other | Si12O24 | 36 | 166 | 685.69 |
mp-1190915 | 1.667829 | 2.745864 | -4.39788 | other | Tc6Cl18 | 24 | 166 | 648.52 |
mp-555170 | -2.984833 | 1.541486 | 2.7138 | other | B12S1 | 13 | 166 | 113.3 |
mp-1215579 | -8.512429 | -4.25299 | 2.09623 | other | Zn1Pd4 | 5 | 166 | 75.87 |
mp-1105040 | -5.449476 | -2.657014 | 3.470111 | other | Ta6Zn7 | 13 | 166 | 199.09 |
mp-1218996 | -6.375531 | -6.411594 | 6.641057 | other | Sm1Th1 | 2 | 166 | 65.26 |
mp-1094477 | -7.994402 | -9.680632 | 4.422219 | other | Mg1Zn1 | 2 | 166 | 38.26 |
mp-23240 | 1.554811 | 2.334819 | -5.205817 | other | Co1Cl2 | 3 | 166 | 64.59 |
mp-1024 | -5.828779 | -5.811533 | 3.724818 | other | Ca2Ge4 | 6 | 166 | 144.19 |
mp-1226850 | -6.498327 | -5.918027 | 5.44059 | other | Ce3Sn1 | 4 | 166 | 112.49 |
mp-1079888 | -4.730523 | -1.654513 | -2.834358 | other | Ti4Se4 | 8 | 166 | 143.54 |
mp-1218357 | -4.995845 | -7.449358 | 3.655879 | other | Sr1Ca1 | 2 | 166 | 99.72 |
mp-1393120 | -5.225637 | -0.544744 | -4.309847 | other | Fe4S8 | 12 | 166 | 202.44 |
mp-1051 | -9.300591 | -1.418146 | 2.908031 | other | Er3Ni9 | 12 | 166 | 165.29 |
mp-567724 | -4.680005 | -0.992689 | -2.922884 | other | Ta1Se2 | 3 | 166 | 70.86 |
mp-1217954 | -6.130917 | -1.852944 | 3.508631 | other | Ta13Ni13 | 26 | 166 | 367.31 |
mp-534 | -2.757264 | 1.535447 | 2.582652 | other | B13N2 | 15 | 166 | 108.04 |
mp-1039305 | -6.133286 | -6.048634 | 0.524185 | other | Mg1Bi1 | 2 | 166 | 56.33 |
mp-1346 | -2.676408 | 1.747494 | 2.740281 | other | B12O2 | 14 | 166 | 102.43 |
mp-30710 | -9.372309 | -6.041957 | 4.29785 | other | Pr2Zn17 | 19 | 166 | 304.48 |
mp-1216236 | -7.530816 | -2.191132 | 2.895967 | other | V1Pt1 | 2 | 166 | 29.1 |
mp-1226997 | -6.096334 | -5.951865 | 5.666942 | other | Ce4Pu1 | 5 | 166 | 118.12 |
mp-571655 | -3.228971 | 1.525525 | 2.78405 | other | B12C3 | 15 | 166 | 138.47 |
mp-542333 | -4.875312 | -1.719387 | -5.724172 | other | Cu9S5 | 14 | 166 | 208.87 |
mp-1094578 | -6.287817 | -9.411223 | 4.589281 | other | Li1Mg1 | 2 | 166 | 42.06 |
mp-9568 | -6.365412 | -6.946523 | 3.854577 | other | Li3Ga2 | 5 | 166 | 73.5 |
mp-30712 | -9.392118 | -6.087857 | 4.262435 | other | Sm2Zn17 | 19 | 166 | 298.62 |
mp-1018275 | -3.467427 | -3.90503 | 0.562799 | other | Ga2P2 | 4 | 166 | 84.1 |
mp-1229015 | -8.356029 | -3.614354 | 2.355 | other | Ag1Pt1 | 2 | 166 | 32.12 |
mp-1220390 | -8.616023 | -6.006174 | 2.356261 | other | Nb1Au4 | 5 | 166 | 90.36 |
mp-540789 | -0.937593 | 2.348035 | -3.023364 | other | Pb2I4 | 6 | 166 | 273.02 |
mp-555037 | -4.008168 | -0.087968 | -3.667037 | other | Ta1S2 | 3 | 166 | 62.97 |
mp-1104956 | -6.552761 | -0.554542 | 4.291 | other | Ta6Fe7 | 13 | 166 | 178.97 |
mp-1068510 | -6.072737 | -3.403166 | -2.066812 | other | In2Te3 | 5 | 166 | 160.28 |
mp-1186405 | -6.420094 | -5.117855 | 4.734921 | other | Pa1Ni1 | 2 | 166 | 40.34 |
mp-28229 | -5.838645 | -3.947898 | -1.819866 | other | Bi4Te3 | 7 | 166 | 251.12 |
mp-1102252 | -8.777446 | -0.264363 | 4.897433 | other | Tm3Co9 | 12 | 166 | 169.13 |
mp-558544 | -5.090775 | 1.000065 | -4.190735 | other | Mo1S2 | 3 | 166 | 55.74 |
mp-1102437 | -8.576163 | -0.414025 | 4.7845 | other | Th3Co9 | 12 | 166 | 181.3 |
mp-1224847 | -8.03847 | -1.128496 | 3.34875 | other | Fe1Rh1 | 2 | 166 | 26.96 |
mp-1390618 | 9.875462 | 9.747056 | -0.208603 | other | Sn1O2 | 3 | 166 | 43.49 |
mp-1271793 | 7.106826 | 13.182655 | -1.870654 | other | Co6O8 | 14 | 166 | 144.75 |
mp-1173456 | 0.888886 | 2.200299 | -3.789462 | other | Ni1Br2 | 3 | 166 | 1,824.72 |
mp-30638 | -7.74078 | 0.178032 | 5.608048 | other | Th3Fe9 | 12 | 166 | 190.71 |
mp-2451 | -6.968966 | -4.363968 | 6.440312 | other | Y3Al9 | 12 | 166 | 232.79 |
mp-1094571 | -5.552269 | -5.912032 | 0.428746 | other | Mg1Sb1 | 2 | 166 | 51.29 |
mp-567747 | -6.358579 | -0.157426 | 3.423146 | other | Co7Mo6 | 13 | 166 | 166.28 |
mp-1218218 | -6.40816 | -0.739692 | 4.258166 | other | Ta13Fe13 | 26 | 166 | 363.96 |
mp-1221812 | -7.134893 | -0.78339 | 4.04857 | other | Mn4Ga1 | 5 | 166 | 58.06 |
mp-1105569 | -7.737944 | 1.029121 | 5.06041 | other | Y2Fe17 | 19 | 166 | 260.12 |
mp-753746 | 8.195507 | 8.412927 | -0.180825 | other | Rb2O1 | 3 | 166 | 96.21 |
mp-990084 | 0.861837 | 1.986863 | -4.544639 | other | Na2Cl1 | 3 | 166 | 90.22 |
mp-25378 | 6.8471 | 11.326754 | -1.311471 | other | Cu1O2 | 3 | 166 | 34.26 |
mp-12648 | -5.0847 | -1.232368 | 4.644082 | other | Ti2Be17 | 19 | 166 | 167.11 |
mp-669713 | -9.220904 | -1.41831 | 2.781412 | other | Gd4Ni14 | 18 | 166 | 254.59 |
mp-1184066 | -4.767542 | -6.589657 | 3.795842 | other | Cs1Th1 | 2 | 166 | 90.64 |
mp-1103885 | -6.67082 | -0.578818 | 4.144499 | original | Nb6Fe7 | 13 | 166 | 181 |
mp-1215575 | -8.629965 | -5.763584 | 2.155325 | other | Zn1Au4 | 5 | 166 | 88 |
mp-1216472 | -0.127431 | 1.970783 | 2.44577 | other | V4N3 | 7 | 166 | 68.17 |
mp-21446 | -6.245823 | -7.025624 | 2.792503 | other | Ba3Pb9 | 12 | 166 | 415.2 |
mp-34202 | -5.969657 | -3.71404 | -1.919677 | other | Bi2Te3 | 5 | 166 | 181.77 |
mp-1228933 | -7.978354 | -0.540758 | 3.810452 | other | Al1Co4 | 5 | 166 | 57.44 |
mp-1224388 | 0.839218 | 1.23676 | 2.784923 | other | Hf3N2 | 5 | 166 | 68.72 |
mp-16506 | -5.864668 | -6.507215 | 4.260997 | other | Li3Al2 | 5 | 166 | 80.13 |
mp-636403 | -9.077017 | -1.467451 | 2.907832 | other | Pu3Ni9 | 12 | 166 | 177.23 |
mp-1226207 | -7.889188 | -2.523585 | 2.703034 | other | Cr1Pt4 | 5 | 166 | 75.18 |
mp-1221442 | -8.190263 | -3.787102 | 2.308306 | other | Mo1Pd4 | 5 | 166 | 77.32 |
mp-1217706 | -6.813886 | -6.613174 | 6.83629 | other | Tb2Ce1 | 3 | 166 | 97.39 |
mp-1219773 | -5.682456 | -4.536784 | 3.503503 | other | Pu3Al1 | 4 | 166 | 70.85 |
mp-1222945 | -6.213738 | -6.240227 | 6.037105 | other | La1Ce4 | 5 | 166 | 138.34 |
mp-1222259 | -6.59386 | -6.283007 | 6.438482 | other | Lu1Th1 | 2 | 166 | 61.17 |
mp-1510 | -7.729432 | 0.994025 | 5.096414 | other | Nd2Fe17 | 19 | 166 | 265.19 |
mp-580062 | -5.895283 | -3.816156 | -1.866931 | other | Bi8Te9 | 17 | 166 | 607.32 |
mp-1226295 | -7.367963 | -6.444015 | 3.273068 | other | Cr1In3 | 4 | 166 | 86.19 |
mp-1222005 | -7.102316 | -0.953746 | 3.882663 | other | Mn3Ge1 | 4 | 166 | 50.48 |
mp-1220368 | -8.284631 | -4.305764 | 2.289557 | other | Nb1Pd4 | 5 | 166 | 80.02 |
mp-1422029 | -5.307587 | -0.645495 | -4.942065 | other | Mn1S2 | 3 | 166 | 63.91 |
mp-880 | -7.735186 | 0.991934 | 5.136691 | other | Pr2Fe17 | 19 | 166 | 267.2 |
mp-978288 | -8.182216 | -9.352633 | 5.07635 | other | Mg3Ni3 | 6 | 166 | 85.44 |
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