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-1096940 | 13.83946 | 6.026229 | -2.292476 | other | Cu1B1O2 | 4 | 166 | 30.94 |
mp-1217291 | -5.50227 | -3.568633 | -2.608077 | other | Te1Pb2Se1 | 4 | 166 | 128.3 |
mp-999448 | -4.208956 | -4.220343 | -3.828447 | other | Na1Y1Se2 | 4 | 166 | 101.94 |
mp-1008511 | -8.42841 | -5.551747 | 4.031888 | other | Ba1Ga1Cu2 | 4 | 166 | 90.37 |
mp-1188842 | -7.963067 | 0.653182 | 3.725605 | other | Tb1Co12B6 | 19 | 166 | 185.26 |
mp-1205300 | -7.907935 | 0.631071 | 3.716985 | other | Tm1Co12B6 | 19 | 166 | 184.07 |
mp-1105066 | -3.729798 | 1.560585 | 2.850749 | other | Pr4Co3B6 | 13 | 166 | 192.27 |
mp-1215435 | 0.943344 | 1.415233 | 2.748013 | other | Zr2B1N1 | 4 | 166 | 53.34 |
mp-1188725 | -7.675436 | 0.896283 | 5.07549 | other | Y2Ga2Fe15 | 19 | 166 | 257.78 |
mp-1191346 | -7.627976 | 1.039057 | 4.778286 | other | Gd2Fe17C3 | 22 | 166 | 270.34 |
mp-1106274 | -8.059157 | 0.665993 | 3.758379 | other | La1Co12B6 | 19 | 166 | 189.47 |
mp-999139 | -3.793855 | -0.28016 | -3.884341 | other | Ta1Hg1S2 | 4 | 166 | 95.93 |
mp-1217826 | -4.261509 | -0.036504 | 2.986017 | other | Ta1W1C2 | 4 | 166 | 43.66 |
mp-9082 | -2.989325 | -2.565949 | -5.607433 | other | Cs1Sm1S2 | 4 | 166 | 122.22 |
mp-999129 | -2.681835 | -2.633114 | -5.682848 | other | K1Tb1S2 | 4 | 166 | 104.21 |
mp-999132 | -5.975069 | -3.877415 | -1.774222 | other | Sm1Tl1Te2 | 4 | 166 | 144.37 |
mp-771777 | 7.561851 | 16.617823 | -0.691581 | other | Li4Mn3O8 | 15 | 166 | 145.72 |
mp-1395990 | -4.726373 | 0.247345 | -4.832074 | other | V4Zn1S8 | 13 | 166 | 235 |
mp-1245913 | 2.176693 | 2.048733 | 1.354109 | other | Mg1In2N2 | 5 | 166 | 75.1 |
mp-1223311 | 1.238975 | 2.488315 | -5.746651 | other | K1Rb1Cl2 | 4 | 166 | 134.31 |
mp-1395180 | -5.210497 | -0.770962 | -5.105749 | other | Ca1Mn4S8 | 13 | 166 | 280.68 |
mp-1093997 | -4.20392 | -1.427011 | -6.023388 | other | Zn2Ga2S5 | 9 | 166 | 178.45 |
mp-2225849 | 11.48949 | 12.774631 | -0.118972 | other | Mg1Cr2O4 | 7 | 166 | 76.6 |
mp-1393946 | -5.381653 | -0.124565 | -5.724658 | other | Ca1Cr4S8 | 13 | 166 | 268.75 |
mp-1086664 | -5.039476 | -5.313385 | 0.339003 | other | Rb1Cd4As3 | 8 | 166 | 226.38 |
mp-27999 | -4.805125 | -6.220452 | 0.620695 | other | K5Cu1Sb2 | 8 | 166 | 287.01 |
mp-754894 | 8.679125 | 15.184933 | -0.586758 | other | Li3Mn4O8 | 15 | 166 | 154.87 |
mp-1066791 | -2.741568 | -2.660104 | -5.783982 | other | Tm1Tl1S2 | 4 | 166 | 101.47 |
mp-1216389 | 0.150981 | 2.124785 | 2.299358 | other | V1Cr1N2 | 4 | 166 | 35.63 |
mp-755581 | 11.21384 | 8.828073 | 2.319339 | other | Na1Ce1O2 | 4 | 166 | 62.17 |
mp-1216057 | -7.86523 | -1.753047 | 4.93171 | other | Y2Ni1Ru3 | 6 | 166 | 102.22 |
mp-1215188 | 0.792529 | 1.412224 | 2.781778 | other | Zr1Ti1N2 | 4 | 166 | 43.92 |
mp-1106200 | -8.522454 | -0.320799 | 4.519218 | other | Ce2Ga2Co15 | 19 | 166 | 251.47 |
mp-1247477 | 2.028173 | 2.290867 | 1.341842 | other | Ag1Sb1N2 | 4 | 166 | 58.08 |
mp-1216066 | -7.923723 | -1.470136 | 5.013444 | other | Y2Co1Ru3 | 6 | 166 | 103.08 |
mp-1216627 | -3.032148 | -0.043767 | 2.681948 | other | U1Ta1C2 | 4 | 166 | 51.02 |
mp-1224370 | -5.671036 | -3.52208 | -2.026486 | other | Ge1Sb2Te4 | 7 | 166 | 213.65 |
mp-996982 | 9.534945 | 8.661749 | -0.401847 | other | Ag1Bi1O2 | 4 | 166 | 75.82 |
mp-7329 | -2.931996 | -2.48729 | -5.183625 | other | K1Ce1S2 | 4 | 166 | 113.82 |
mp-999288 | -5.971303 | -3.889017 | -1.810821 | other | Pr1Tl1Te2 | 4 | 166 | 149.45 |
mp-1221838 | 9.563557 | 13.337661 | -1.794253 | other | Mn3Cr2O8 | 13 | 166 | 153.31 |
mp-10441 | -5.334555 | -4.335135 | 0.625823 | other | Sr1Cu4As2 | 7 | 166 | 117.92 |
mp-1018025 | 10.097664 | 8.962181 | 2.8054 | other | Lu1Ag1O2 | 4 | 166 | 61.08 |
mp-1215198 | -3.604038 | 1.770502 | 2.858115 | other | Zr1U1B24 | 26 | 166 | 205.09 |
mp-13695 | 9.588908 | 8.974556 | 2.528154 | other | Sm1Cu1O2 | 4 | 166 | 66 |
mp-557655 | -2.885196 | -2.484287 | -5.683161 | other | Gd1Tl1S2 | 4 | 166 | 107.26 |
mp-754789 | 10.111721 | 13.088967 | -1.796911 | other | Na2Cr7O14 | 23 | 166 | 268.98 |
mp-1078999 | 3.122419 | -0.562379 | -2.072604 | other | Nd1Al1H6 | 8 | 166 | 73.53 |
mp-1007685 | -4.851917 | -2.691772 | -4.052786 | other | In1Ag1Se2 | 4 | 166 | 92.69 |
mp-561619 | -3.015988 | -2.5217 | -5.648749 | other | Cs1Lu1S2 | 4 | 166 | 110.81 |
mp-1402995 | -4.712027 | 0.257408 | -4.84871 | other | Mg1V4S8 | 13 | 166 | 236.17 |
mp-22566 | -3.869891 | -1.624426 | -5.596713 | other | Tl1In1S2 | 4 | 166 | 97.12 |
mp-7439 | -3.78598 | -4.689931 | 0.589323 | other | K3Cu3P2 | 8 | 166 | 184.71 |
mp-10988 | -4.651445 | -3.778154 | -3.827939 | other | Na1Yb1Se2 | 4 | 166 | 106.37 |
mp-1226608 | 7.101534 | 8.381508 | -0.9755 | original | Ce1Pr4O10 | 15 | 166 | 228.46 |
mp-1221540 | -5.349866 | -1.062799 | -4.195041 | other | Mn2Se1S1 | 4 | 166 | 56.56 |
mp-759191 | 6.545841 | 14.23729 | -1.821552 | other | Li3Co4O8 | 15 | 166 | 135.12 |
mp-19378 | 10.929293 | 13.066313 | -0.441716 | other | Cr1Ag1O2 | 4 | 166 | 47.99 |
mp-1006888 | -2.737451 | -2.570286 | -5.697598 | other | K1Y1S2 | 4 | 166 | 103.62 |
mp-753226 | 9.629623 | 9.060099 | 2.617705 | other | Sm1Ag1O2 | 4 | 166 | 70.94 |
mp-11740 | -5.876553 | -3.842892 | -1.73977 | other | K1Nd1Te2 | 4 | 166 | 151.61 |
mp-30041 | -3.913874 | -1.987844 | -5.280245 | other | Rb1Bi1S2 | 4 | 166 | 115.36 |
mp-546292 | 7.571298 | 8.636129 | -1.997807 | other | Yb2Cl2O2 | 6 | 166 | 120.84 |
mp-1217998 | -3.91302 | -1.706022 | -5.69548 | other | Sr1Cd4S5 | 10 | 166 | 221.58 |
mp-753898 | 11.737366 | 8.867633 | 1.704881 | other | La1Tm1O2 | 4 | 166 | 61.41 |
mp-3857 | 13.064344 | 5.725169 | -5.525049 | other | Ba3P2O8 | 13 | 166 | 193.22 |
mp-1226924 | 10.909572 | 8.567019 | 2.605128 | other | Ce3U1O8 | 12 | 166 | 163.4 |
mp-1246039 | 2.37854 | 2.386445 | 1.201849 | other | In1B1N2 | 4 | 166 | 51.27 |
mp-570097 | -3.537735 | -4.420978 | 0.891671 | other | Sr1Li4P2 | 7 | 166 | 124.09 |
mp-1222754 | -7.861249 | -9.443118 | 6.75745 | other | La1Y1Mg6 | 8 | 166 | 202.16 |
mp-8710 | 8.035044 | 11.018978 | -0.635382 | other | Ca2Pt3O8 | 13 | 166 | 172.94 |
mp-22473 | -4.76053 | -3.016707 | -4.007896 | other | Na1In1Se2 | 4 | 166 | 96.19 |
mp-4494 | -3.04349 | -2.273859 | -5.190634 | other | Na1Yb1S2 | 4 | 166 | 93.33 |
mp-1225678 | -4.729897 | -2.969523 | -3.802155 | other | Cu1Bi1Se2 | 4 | 166 | 91.14 |
mp-10780 | -4.328236 | -4.109706 | -3.755516 | other | Rb1Sm1Se2 | 4 | 166 | 128.11 |
mp-10778 | -4.304373 | -4.09242 | -3.792026 | other | Rb1Pr1Se2 | 4 | 166 | 133.65 |
mp-1225790 | 8.128065 | 12.270039 | -0.916043 | other | Cu1Ni3O4 | 8 | 166 | 75.61 |
mp-1215554 | -7.739302 | -0.790072 | 4.59059 | other | Zr2Fe1Co3 | 6 | 166 | 85.57 |
mp-758972 | 6.319696 | 13.707711 | -2.240769 | other | Li2Co8O16 | 26 | 166 | 264.53 |
mp-675011 | 8.606561 | 1.623544 | -0.173056 | other | Cs1P1F6 | 8 | 166 | 131.38 |
mp-753551 | 6.509465 | 13.590284 | -2.337915 | other | Mn1Co3O8 | 12 | 166 | 129.2 |
mp-1245869 | 5.069758 | 2.179926 | -2.488839 | other | Sn1C1N2 | 4 | 166 | 66.87 |
mp-1103959 | -3.875317 | 1.646986 | 2.951761 | other | Ho4Co3B6 | 13 | 166 | 175.85 |
mp-1178276 | 11.350115 | 9.039046 | -0.808811 | other | Ga1Pt1O2 | 4 | 166 | 46.66 |
mp-1246537 | 0.304497 | 2.644876 | 1.832392 | other | Fe2Ni1N2 | 5 | 166 | 52.65 |
mp-33737 | 8.703658 | 14.257544 | -1.158894 | other | Mn3Cu3O8 | 14 | 166 | 140.24 |
mp-22338 | 7.823675 | 8.640546 | -0.077683 | other | Eu2O2F2 | 6 | 166 | 84.93 |
mp-1245560 | 0.645478 | 2.022187 | 2.320646 | other | Zr1Mn1N2 | 4 | 166 | 40.41 |
mp-1222885 | -3.372197 | -4.088716 | -3.027571 | other | La1Er1Se2 | 4 | 166 | 102.19 |
mp-645286 | -7.975393 | 0.669733 | 3.739929 | other | Gd1Co12B6 | 19 | 166 | 185.67 |
mp-1224571 | 2.308616 | 1.690595 | 1.874517 | other | Gd1Th1N2 | 4 | 166 | 65.69 |
mp-753202 | 9.955426 | 0.446821 | 0.242134 | other | Li5Cu1F8 | 14 | 166 | 134.24 |
mp-1216707 | -3.712596 | -0.282192 | 2.936767 | other | Ti1Nb1C2 | 4 | 166 | 43.25 |
mp-1018051 | -3.71863 | -0.846155 | -4.87997 | original | K1Ti1S2 | 4 | 166 | 84.77 |
mp-1188251 | -7.97763 | 0.651727 | 3.744745 | other | Y1Co12B6 | 19 | 166 | 185.43 |
mp-25417 | 12.816093 | 11.403415 | 1.422941 | other | Li1Ti1O2 | 4 | 166 | 36.92 |
mp-1215195 | -2.837669 | -0.086434 | 2.723518 | original | Zr1U1C2 | 4 | 166 | 56.34 |
mp-9783 | 11.91341 | 7.06398 | -3.719703 | other | Ba3As2O8 | 13 | 166 | 208.26 |
mp-33551 | 8.618778 | 13.34173 | -1.220775 | other | Li1Fe5O8 | 14 | 166 | 140.4 |
mp-1228559 | -8.485412 | -0.474604 | 2.365455 | other | Al5Ni41B12 | 58 | 166 | 572.7 |
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