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-1185980 | -7.466769 | -1.857934 | 3.91624 | other | Mg1Sn1Ru2 | 4 | 225 | 62.28 |
mp-867850 | -8.509632 | -2.312503 | 3.705234 | other | Sc1Mn1Rh2 | 4 | 225 | 61.16 |
mp-2210713 | 12.086321 | 10.561193 | 0.869508 | other | Mg1Cr1O2 | 4 | 225 | 39.9 |
mp-865545 | -7.222036 | -6.930779 | 6.223526 | other | Pm2Si1Au1 | 4 | 225 | 97.54 |
mp-862774 | -8.204347 | -3.683239 | 2.871895 | other | Li1In1Pt2 | 4 | 225 | 62.11 |
mp-863665 | -8.76528 | -6.264491 | 6.285481 | other | Pm2Cu1Ir1 | 4 | 225 | 86.94 |
mp-866082 | -8.065382 | -4.582587 | 5.23059 | other | Mg1Sc2Tc1 | 4 | 225 | 76.07 |
mp-504778 | 8.883944 | 2.330985 | 0.550173 | other | Na1Mo1F6 | 8 | 225 | 141.34 |
mp-1112350 | 1.323886 | 2.588283 | -6.151787 | other | Cs3Sc1Cl6 | 10 | 225 | 386.69 |
mp-867254 | -9.038506 | -6.468988 | 2.721564 | other | Sm1Ag1Au2 | 4 | 225 | 84.26 |
mp-1187018 | -8.643838 | -6.224729 | 6.908469 | other | Sm2Ni1Ru1 | 4 | 225 | 83.98 |
mp-13915 | -7.874046 | -2.230738 | 2.352976 | other | Li1Ni2Sn1 | 4 | 225 | 52.43 |
mp-1185413 | -7.582443 | -6.967096 | 6.599693 | other | Li1Pm2Co1 | 4 | 225 | 86.93 |
mp-1187026 | -8.196275 | -7.769749 | 4.533772 | other | Sm1Y1Hg2 | 4 | 225 | 104.79 |
mp-1205668 | 9.085773 | 11.241134 | 1.109432 | other | Sr3Mo1O6 | 10 | 225 | 158.49 |
mp-1208981 | -8.177399 | -4.427035 | 2.201526 | other | Sm3Si6Pd20 | 29 | 225 | 462.9 |
mp-1207415 | -5.566442 | -1.253095 | 4.355851 | other | Zr6Be15Co8 | 29 | 225 | 330.7 |
mp-1187327 | -8.305758 | -7.68831 | 4.552445 | other | Tb1Dy1Hg2 | 4 | 225 | 101.39 |
mp-972961 | -8.195153 | -4.108074 | 4.711968 | other | Sc2Ni1Rh1 | 4 | 225 | 66.24 |
mp-975886 | -8.294581 | -6.95361 | 5.401741 | other | Pr1Sm1Zn2 | 4 | 225 | 97.81 |
mp-1183038 | -8.059966 | -2.530115 | 4.108838 | other | Zr1Zn1Ir2 | 4 | 225 | 62.79 |
mp-866283 | -8.638802 | -5.054523 | 5.449586 | other | Ca1Ho1Rh2 | 4 | 225 | 77.37 |
mp-1187445 | -5.943627 | -1.77297 | 4.424692 | other | Th1Pa1Tc2 | 4 | 225 | 86.48 |
mp-971924 | -8.463492 | -6.859874 | 4.647062 | other | Dy1Y1Ag2 | 4 | 225 | 94.52 |
mp-1213204 | -7.762747 | -4.253276 | 1.395697 | other | Dy3P6Pd20 | 29 | 225 | 452.43 |
mp-862321 | -6.923614 | -4.210618 | 1.124994 | other | Li1As1Pd2 | 4 | 225 | 56.57 |
mp-864786 | -8.069718 | -4.85902 | 3.476642 | other | Yb2Pd1Pt1 | 4 | 225 | 81.22 |
mp-1112654 | -1.267414 | 3.12554 | -2.996612 | other | Cs3Al1I6 | 10 | 225 | 523.41 |
mp-1183555 | -7.926988 | -6.944098 | 4.076705 | other | Ca1Nd1Ag2 | 4 | 225 | 101.6 |
mp-1184980 | -6.560485 | -6.253735 | 4.577229 | other | Li2Ce1Ga1 | 4 | 225 | 76.05 |
mp-865026 | -6.272419 | -0.799449 | 3.582155 | other | Mn2V1Si1 | 4 | 225 | 44.71 |
mp-1183179 | -7.686093 | -8.812574 | 6.57799 | other | Ac1Nd1Mg2 | 4 | 225 | 128.19 |
mp-972626 | -9.002918 | -6.347534 | 2.797581 | other | Sm1Ga1Au2 | 4 | 225 | 82.08 |
mp-861627 | -5.858079 | -2.179073 | 4.165292 | other | Ti2Al1Mo1 | 4 | 225 | 63.65 |
mp-1187876 | -8.474072 | -2.936479 | 3.458172 | other | Y1Rh2Pb1 | 4 | 225 | 75.44 |
mp-862933 | -8.899329 | -6.14442 | 2.808927 | other | Pm1Mg1Au2 | 4 | 225 | 86.22 |
mp-979435 | -7.991808 | -8.982136 | 6.565712 | other | Y1Mg2Sc1 | 4 | 225 | 101.2 |
mp-982559 | -9.068645 | -6.325413 | 2.858615 | other | Ho1Al1Au2 | 4 | 225 | 79.1 |
mp-1193281 | -8.145896 | -3.277648 | 5.025275 | other | Sc6Ga16Ir7 | 29 | 225 | 472.15 |
mp-1184999 | -8.968991 | -6.289753 | 2.843235 | other | La1Mg1Au2 | 4 | 225 | 91.83 |
mp-631532 | -4.700637 | -6.363558 | 2.917989 | other | Ba1Be2Te1 | 4 | 225 | 95.31 |
mp-865169 | -8.698314 | -4.981618 | 5.451659 | other | Ca1Er1Rh2 | 4 | 225 | 76.78 |
mp-862745 | -5.443201 | -6.87471 | 3.407342 | other | Sr2Li1Pt1 | 4 | 225 | 110.73 |
mp-5778 | -6.975472 | -0.148124 | 3.745675 | other | Al1V1Fe2 | 4 | 225 | 45.26 |
mp-867299 | -6.499834 | -6.866674 | 3.34097 | other | Eu2Hg1Ge1 | 4 | 225 | 111.55 |
mp-1110845 | 8.217488 | 1.211447 | 1.096001 | other | K3Sb1F6 | 10 | 225 | 211.81 |
mp-1184847 | -9.102872 | -5.373302 | 6.085392 | other | Ho1Lu1Ir2 | 4 | 225 | 75.89 |
mp-1187890 | -6.898758 | -6.564117 | 4.067756 | other | Yb2In1Ga1 | 4 | 225 | 105.31 |
mp-1183831 | -8.966908 | -5.377482 | 6.055843 | other | Dy1Lu1Rh2 | 4 | 225 | 76.14 |
mp-1184352 | -8.22761 | -7.166621 | 5.346866 | other | Gd2Ag1Hg1 | 4 | 225 | 100.74 |
mp-1185408 | -8.362226 | -6.77686 | 5.10935 | other | Li1Pr1Zn2 | 4 | 225 | 82.35 |
mp-1185430 | -9.487625 | -4.839906 | 3.903764 | other | Li1Zn1Cu2 | 4 | 225 | 48.73 |
mp-22610 | -6.609061 | -0.990748 | 3.579892 | other | Mn2Sn1W1 | 4 | 225 | 56.78 |
mp-861892 | -8.552561 | -2.953859 | 3.940554 | other | Dy1In1Rh2 | 4 | 225 | 71.59 |
mp-1185243 | -5.872452 | -7.1976 | 4.280199 | other | Li1Yb2Al1 | 4 | 225 | 108.29 |
mp-1183118 | -7.685152 | -7.18438 | 4.782132 | other | Ac1La1Cd2 | 4 | 225 | 128.27 |
mp-1188017 | -6.079811 | -1.695045 | 4.265769 | other | Zr1Sc1Tc2 | 4 | 225 | 69.1 |
mp-1184201 | 1.546442 | 2.663604 | -5.804282 | other | Cs8Sb4Cl24 | 36 | 225 | 1,164.84 |
mp-865471 | -6.056523 | -1.016531 | 3.99283 | other | V1Ga1Tc2 | 4 | 225 | 55.24 |
mp-1184846 | -8.246778 | -3.732903 | 5.732898 | other | Ho1Th1Ru2 | 4 | 225 | 82.85 |
mp-1187039 | -8.432947 | -5.350585 | 2.890109 | other | Sm1Pd2Pb1 | 4 | 225 | 84.84 |
mp-865017 | -8.648464 | -6.32487 | 6.790308 | other | Dy2Zn1Ru1 | 4 | 225 | 82.08 |
mp-1113832 | 8.278891 | 0.541051 | 0.708606 | other | Rb3Au1F6 | 10 | 225 | 218.11 |
mp-1184389 | -7.722904 | -7.584429 | 2.413148 | other | Eu1Ag1Hg2 | 4 | 225 | 101.26 |
mp-1185986 | -7.973069 | -1.66711 | 3.609183 | other | Mn1Be1Ir2 | 4 | 225 | 49.3 |
mp-1186611 | -7.896076 | -6.377139 | 6.008514 | other | Pm1Nd1Ga2 | 4 | 225 | 98.98 |
mp-865730 | -8.811347 | -5.92395 | 2.708893 | other | Ti1Zn1Au2 | 4 | 225 | 64.91 |
mp-1187800 | -9.191877 | -3.944134 | 3.188496 | other | Zn2Cu1Rh1 | 4 | 225 | 51.88 |
mp-1110881 | 1.128759 | 2.154276 | -5.747301 | other | K3Pr1Cl6 | 10 | 225 | 375.81 |
mp-867269 | -8.571337 | -6.348958 | 6.914701 | other | Li1Ho2Os1 | 4 | 225 | 80.61 |
mp-865630 | -7.225469 | -6.26084 | 3.613704 | other | Yb2Ag1Ge1 | 4 | 225 | 93.39 |
mp-1113503 | 1.251805 | 2.041057 | -5.476532 | other | Na3Nd1Cl6 | 10 | 225 | 318.22 |
mp-1183421 | -6.016663 | -1.312613 | 4.031297 | other | Be2Ni1Ru1 | 4 | 225 | 38.81 |
mp-1184408 | -7.590113 | -7.601794 | 2.587161 | other | Eu1In1Hg2 | 4 | 225 | 101.77 |
mp-864600 | -8.469317 | -2.90172 | 3.426847 | other | Tb1Sn1Rh2 | 4 | 225 | 72.53 |
mp-1186509 | -8.514135 | -6.670794 | 6.61024 | other | Pm2Ga1Ru1 | 4 | 225 | 90.87 |
mp-22947 | 1.531206 | 2.58459 | -5.126869 | other | K2Re1Cl6 | 9 | 225 | 239.5 |
mp-1186613 | -7.955826 | -8.793774 | 6.810624 | other | Pm1Lu1Mg2 | 4 | 225 | 109.37 |
mp-977586 | -7.957833 | -5.649597 | 5.152279 | other | Mg1Sc2In1 | 4 | 225 | 89.76 |
mp-1183884 | -6.01171 | -7.231636 | 3.737748 | other | Eu2Mg1Tl1 | 4 | 225 | 126.21 |
mp-20463 | 8.198307 | 1.230805 | 0.007936 | other | Ca1Pb1F6 | 8 | 225 | 160.91 |
mp-1183072 | -7.032172 | -7.903605 | 4.942874 | other | Ac2Tl1Cd1 | 4 | 225 | 138.27 |
mp-973276 | -8.19897 | -6.862505 | 5.236659 | other | Ho1Lu1Cd2 | 4 | 225 | 98.93 |
mp-1186954 | -8.262225 | -4.285048 | 4.825901 | other | Sc2Ir1Os1 | 4 | 225 | 66.21 |
mp-631277 | -6.145633 | -2.082494 | 4.149202 | other | Sr1Cr1W2 | 4 | 225 | 70.29 |
mp-1147639 | 7.445258 | 10.582624 | -0.820917 | other | Cd1Cu6O8 | 15 | 225 | 198.6 |
mp-647205 | -8.603547 | -0.387501 | 2.463412 | other | Sc2Ni21B6 | 29 | 225 | 286.67 |
mp-1185985 | -6.082322 | -1.210292 | 4.415163 | other | Mn1Be2Ru1 | 4 | 225 | 42.38 |
mp-865979 | -7.374443 | -7.488391 | 4.399383 | other | Ac1Mg1Cd2 | 4 | 225 | 110.98 |
mp-972971 | -7.980543 | -8.170244 | 3.370667 | original | La1Tl1Hg2 | 4 | 225 | 107.13 |
mp-581707 | -8.775206 | -6.239399 | 2.803014 | other | Zr1In1Au2 | 4 | 225 | 77.71 |
mp-865483 | -6.76303 | -6.977178 | 4.787539 | other | Li2Gd1In1 | 4 | 225 | 81.41 |
mp-973442 | -8.736856 | -5.634649 | 5.542714 | other | Lu2Ag1Pt1 | 4 | 225 | 82.01 |
mp-1205907 | 1.551644 | 2.329369 | -3.569828 | other | Ir1Br6N2 | 9 | 225 | 272.39 |
mp-867271 | -6.366962 | -1.085181 | 3.913862 | other | Be2Co1Ni1 | 4 | 225 | 34.09 |
mp-866153 | -8.146522 | -2.450605 | 3.87852 | other | Ti1Al1Rh2 | 4 | 225 | 56.23 |
mp-1184477 | -8.421736 | -7.152406 | 3.440685 | other | Gd1Cd1Ag2 | 4 | 225 | 85.61 |
mp-862896 | -8.723042 | -3.180612 | 3.758835 | other | Pm1Cd1Rh2 | 4 | 225 | 74.67 |
mp-864983 | -7.21456 | -1.035966 | 3.991667 | other | Mn1V1Ru2 | 4 | 225 | 53.93 |
mp-3498 | -8.106094 | -2.230364 | 2.967491 | other | Hf1Ga1Ni2 | 4 | 225 | 54.31 |
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