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-1205000 | -7.947007 | -7.210805 | 3.873475 | other | Nd22Cd90 | 112 | 216 | 2,691.63 |
mp-1007770 | -4.968705 | -5.514132 | 0.491293 | other | Tl1As1 | 2 | 216 | 64.31 |
mp-1059612 | 1.883781 | 2.834763 | 0.430426 | other | Li1N1 | 2 | 216 | 25.56 |
mp-22913 | -0.39951 | 1.561795 | -4.580785 | other | Cu1Br1 | 2 | 216 | 45.25 |
mp-2624 | -5.281922 | -5.739391 | 0.58304 | original | Al1Sb1 | 2 | 216 | 59.15 |
mp-1008726 | -5.3692 | -3.084486 | 3.789555 | other | Ti2Ga1 | 3 | 216 | 60.48 |
mp-569673 | -1.146457 | 1.210477 | -1.512185 | other | Pr4I8 | 12 | 216 | 497.47 |
mp-760381 | -4.856837 | -1.411562 | -5.629521 | other | Cu1S1 | 2 | 216 | 34.35 |
mp-1009753 | -5.032059 | -6.034636 | 3.001554 | other | Sc1Ge1 | 2 | 216 | 60.36 |
mp-1700 | 2.375065 | 2.051861 | 1.874688 | other | Al1N1 | 2 | 216 | 20.83 |
mp-1094183 | -5.591876 | -6.173606 | 4.513479 | other | Hf1Mg1 | 2 | 216 | 70.61 |
mp-1009766 | 1.429665 | 2.220721 | -0.531581 | other | Ag1N1 | 2 | 216 | 30.32 |
mp-1006882 | -4.405207 | -5.626185 | 2.470452 | other | Cd1C1 | 2 | 216 | 34.88 |
mp-1009491 | -5.602665 | -3.755607 | -1.754967 | other | Rb1Te1 | 2 | 216 | 148.35 |
mp-1215027 | -7.277808 | -3.889939 | 5.343979 | other | Al84Pt20 | 104 | 216 | 1,689.75 |
mp-30603 | -9.51239 | -4.710203 | 4.135612 | other | Zr1Cu5 | 6 | 216 | 79.41 |
mp-1080388 | -7.87403 | -3.2136 | 2.554013 | other | Pu1Pt5 | 6 | 216 | 105.15 |
mp-1018126 | -5.967321 | -5.744339 | 0.577138 | other | Ga1Bi1 | 2 | 216 | 64.48 |
mp-574275 | -6.366285 | -6.980363 | 3.10236 | other | Li85Pb20 | 105 | 216 | 1,984.47 |
mp-568920 | -8.578936 | -6.206341 | 2.241256 | other | Ca1Au5 | 6 | 216 | 118.62 |
mp-22408 | 8.189385 | 12.461922 | -1.349009 | other | Co2O2 | 4 | 216 | 45.65 |
mp-1199872 | -7.838469 | -7.975259 | 2.777108 | other | Pr22Hg90 | 112 | 216 | 2,828.51 |
mp-1229052 | -6.450301 | -2.720202 | 6.398668 | other | Al41V4 | 45 | 216 | 735.79 |
mp-1224310 | -5.413636 | -5.532921 | 0.470513 | other | Ge1Sb1 | 2 | 216 | 66.47 |
mp-1212554 | -7.590093 | -10.410663 | 5.211003 | other | Mg87Pd12 | 99 | 216 | 2,066.94 |
mp-13031 | -4.755541 | -3.660991 | -4.108186 | other | Mg1Se1 | 2 | 216 | 52.34 |
mp-8222 | 7.200897 | 9.396511 | -1.566373 | other | Ag1O1 | 2 | 216 | 32.52 |
mp-1039025 | -4.6349 | -7.743497 | 2.111597 | other | Mg1Cd1 | 2 | 216 | 73.43 |
mp-1001916 | 1.050434 | 1.509449 | 2.645221 | other | Hf1N1 | 2 | 216 | 29.59 |
mp-8373 | -3.498635 | -3.765256 | 0.43905 | other | Ge1P1 | 2 | 216 | 46.92 |
mp-1228138 | 11.118567 | 8.150514 | -0.187544 | other | Al5O8 | 13 | 216 | 127.5 |
mp-1008926 | -6.452214 | -2.808093 | -1.62534 | other | Cr1Te1 | 2 | 216 | 60.85 |
mp-1009540 | -5.12277 | -0.344103 | 3.139638 | other | Os1C1 | 2 | 216 | 24.53 |
mp-1009218 | -3.804778 | 0.418043 | 2.818668 | other | Mo1C1 | 2 | 216 | 25.93 |
mp-2490 | -3.436637 | -3.911008 | 0.575663 | other | Ga1P1 | 2 | 216 | 40.51 |
mp-567903 | -2.235223 | -8.52765 | 1.368465 | other | Zn1Ni1 | 2 | 216 | 38.2 |
mp-1094391 | -6.338455 | -7.131588 | 5.262195 | other | Y1Mg1 | 2 | 216 | 89.12 |
mp-31499 | -7.849289 | -10.120811 | 5.538998 | other | Mg87Ir12 | 99 | 216 | 1,965.37 |
mp-8062 | -1.155579 | 0.582366 | 2.356364 | other | Si1C1 | 2 | 216 | 20.63 |
mp-569516 | -8.605134 | -1.540002 | 2.902749 | other | Hf1Ni5 | 6 | 216 | 71.75 |
mp-1123 | -3.838096 | -1.472862 | -5.701859 | other | Hg1S1 | 2 | 216 | 52.38 |
mp-1204063 | -6.347756 | -6.738579 | 3.496388 | other | Li88Ge20 | 108 | 216 | 1,678.53 |
mp-22895 | -1.308671 | 2.509373 | -3.242024 | other | Cu4I4 | 8 | 216 | 217.82 |
mp-998894 | -6.567415 | -6.193379 | 5.756104 | other | Y1C1 | 2 | 216 | 40.8 |
mp-1062072 | -7.193635 | -1.36196 | 5.361829 | other | Y1Mn2 | 3 | 216 | 67.41 |
mp-13032 | -3.771459 | -1.784007 | -5.723452 | other | Mg1S1 | 2 | 216 | 45.48 |
mp-13174 | 0.724817 | 1.97761 | 1.726133 | other | Pt1N1 | 2 | 216 | 27.33 |
mp-1204723 | -7.833969 | -7.242343 | 3.695352 | other | Er22Cd90 | 112 | 216 | 2,556.82 |
mp-1219856 | -2.695263 | -2.678435 | -5.668638 | other | Pr5S8 | 13 | 216 | 426.23 |
mp-20411 | 2.122276 | 2.088594 | 1.236012 | other | In1N1 | 2 | 216 | 31.35 |
mp-1224137 | -4.041167 | -1.316897 | -5.720502 | other | In5S8 | 13 | 216 | 310.79 |
mp-1077262 | -9.60829 | -4.731546 | 4.109396 | other | Tb1Cu5 | 6 | 216 | 84.51 |
mp-1783 | -5.478279 | -0.815029 | -4.764305 | other | Mn1S1 | 2 | 216 | 30.27 |
mp-1002219 | -5.398684 | -6.236773 | 0.664195 | other | Tl1Sb1 | 2 | 216 | 78.33 |
mp-1009770 | 0.536803 | 2.043795 | 1.858166 | other | Ru1N1 | 2 | 216 | 23.77 |
mp-1219182 | -3.832888 | -4.691822 | 5.809802 | other | Si1Ge1 | 2 | 216 | 42.58 |
mp-1018157 | 0.564028 | 2.256455 | 2.108148 | other | Cr1N1 | 2 | 216 | 21.29 |
mp-1009894 | -2.805726 | -0.28687 | 2.889335 | other | Zr1C1 | 2 | 216 | 33.28 |
mp-1007776 | -3.315278 | -4.344098 | 1.007371 | other | Tl1P1 | 2 | 216 | 57.31 |
mp-29720 | -4.500489 | -5.552933 | 5.000465 | other | Li84Si20 | 104 | 216 | 1,591.26 |
mp-820 | -4.535684 | -2.367824 | -4.272415 | other | Hg1Se1 | 2 | 216 | 59.37 |
mp-1009885 | 1.198843 | 1.566977 | 2.719828 | other | Zr1N1 | 2 | 216 | 31.08 |
mp-1070625 | 7.799494 | 6.698319 | -4.836131 | other | S1O4 | 5 | 216 | 108.62 |
mp-542598 | -4.54788 | -5.57572 | 4.950323 | other | Li88Si20 | 108 | 216 | 1,620.39 |
mp-1008558 | 1.442682 | 2.252252 | 0.563872 | other | Au1N1 | 2 | 216 | 30.92 |
mp-1007778 | 1.557412 | 2.532524 | 0.592297 | other | Tl1N1 | 2 | 216 | 36.63 |
mp-1009131 | -5.230251 | -4.246297 | 0.471236 | other | Mn1As1 | 2 | 216 | 46.01 |
mp-2469 | -4.225326 | -1.491621 | -5.643707 | other | Cd1S1 | 2 | 216 | 50.98 |
mp-1204245 | -7.928675 | -7.217437 | 3.815024 | other | Pr22Cd90 | 112 | 216 | 2,649.27 |
mp-422 | -4.945083 | -1.198254 | -6.269711 | other | Be1S1 | 2 | 216 | 28.88 |
mp-20012 | -5.390998 | -5.775867 | 0.443655 | other | In1Sb1 | 2 | 216 | 72.96 |
mp-1038783 | -5.393706 | -7.289293 | 3.434379 | other | Ca1Zn1 | 2 | 216 | 77.36 |
mp-1541 | -5.059346 | -2.757704 | -3.988933 | other | Be1Se1 | 2 | 216 | 34.51 |
mp-22914 | 0.970685 | 1.990479 | -5.314868 | other | Cu1Cl1 | 2 | 216 | 38.41 |
mp-1199736 | -7.865959 | -7.258791 | 3.720185 | other | Y22Cd90 | 112 | 216 | 2,584.67 |
mp-1002184 | -5.605798 | -0.034663 | 3.484414 | other | Tc1B1 | 2 | 216 | 26.53 |
mp-1009832 | -3.059047 | -0.126783 | 2.856623 | other | Ta1C1 | 2 | 216 | 28.32 |
mp-22925 | -1.236634 | 2.796528 | -3.078849 | other | Ag1I1 | 2 | 216 | 70.71 |
mp-1009538 | -5.689224 | -5.092276 | 2.216627 | other | Pd1C1 | 2 | 216 | 26.35 |
mp-1009848 | -4.810428 | -0.108675 | 3.309191 | other | Tc1C1 | 2 | 216 | 24.87 |
mp-1009813 | -3.839406 | -5.068118 | 5.347486 | other | Si1Sn1 | 2 | 216 | 55.89 |
mp-1224769 | -6.015267 | -5.532274 | 3.516635 | other | Ga1Ge1 | 2 | 216 | 48.67 |
mp-569273 | -7.897963 | -10.020035 | 5.532632 | other | Mg88Ir14 | 102 | 216 | 1,984.75 |
mp-1009458 | -3.339812 | -0.507839 | 2.724166 | other | Nb1C1 | 2 | 216 | 28.71 |
mp-1103613 | -3.19217 | 1.579795 | 2.865703 | other | Li1B11 | 12 | 216 | 85.63 |
mp-1201594 | -7.852528 | -8.028846 | 2.73309 | other | Nd22Hg90 | 112 | 216 | 2,806.86 |
mp-30578 | -9.650616 | -4.725921 | 4.108075 | other | Dy1Cu5 | 6 | 216 | 83.97 |
mp-622511 | -6.09766 | -3.457165 | -2.069281 | other | In18Te27 | 45 | 216 | 1,707.83 |
mp-13116 | 0.588168 | 2.738206 | 1.652128 | other | Ni1N1 | 2 | 216 | 20.09 |
mp-1002164 | -0.984649 | 0.436421 | 1.807205 | other | Ge1C1 | 2 | 216 | 24.4 |
mp-1025010 | -5.351197 | -1.225091 | 4.703983 | other | Be5Fe1 | 6 | 216 | 49.76 |
mp-1008875 | -6.621823 | -2.679534 | 0.749782 | other | Mn2Sb1 | 3 | 216 | 54.21 |
mp-30579 | -9.598741 | -4.709808 | 4.077328 | other | Er1Cu5 | 6 | 216 | 83.03 |
mp-2176 | -6.157988 | -3.29565 | -2.367138 | other | Zn3Te3 | 6 | 216 | 171.18 |
mp-580136 | -9.573824 | -4.73173 | 4.057799 | other | Lu1Cu5 | 6 | 216 | 81.8 |
mp-1009222 | -6.039505 | -3.182134 | -1.842061 | other | Mn1Te1 | 2 | 216 | 64.92 |
mp-1215375 | -3.921604 | -0.909475 | -4.279242 | other | Zr5S8 | 13 | 216 | 297.08 |
mp-1001837 | -4.595401 | -1.871882 | 1.163515 | other | Mo1P1 | 2 | 216 | 40.04 |
mp-1008921 | 1.786567 | 2.604507 | 0.578945 | other | Cd1N1 | 2 | 216 | 34.07 |
mp-1009734 | 0.840703 | 2.377477 | 1.692843 | other | Rh1N1 | 2 | 216 | 24.68 |
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