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-505531 | -5.06404 | -0.976519 | -4.246884 | other | Fe2S2 | 4 | 129 | 67.99 |
mp-1018717 | -5.882449 | -3.632236 | 1.797451 | other | Hf2Sb4 | 6 | 129 | 145.08 |
mp-21657 | -4.482554 | -3.087976 | -4.12503 | other | Tl20Se12 | 32 | 130 | 946.87 |
mp-1198012 | -8.069242 | -5.351462 | 4.179879 | other | Yb20Ir12 | 32 | 130 | 729.71 |
mp-669594 | -7.844265 | -6.59835 | 6.517989 | other | Pr20Ga12 | 32 | 130 | 926.19 |
mp-1201811 | 6.575881 | 5.835251 | -3.593274 | other | Sr4O40 | 44 | 130 | 561.21 |
mp-1199558 | -8.82577 | -6.194211 | 6.659887 | other | Sm20Ir12 | 32 | 130 | 795.25 |
mp-1179215 | 6.583218 | 5.849614 | -3.573198 | other | Sr4O40 | 44 | 130 | 558.16 |
mp-1200226 | -9.029427 | -6.078938 | 6.52685 | other | Dy20Ir12 | 32 | 130 | 744.69 |
mp-1178787 | 12.130237 | 13.398248 | -2.531471 | other | V16O32 | 48 | 130 | 575.28 |
mp-1205022 | -5.850586 | -3.209926 | -1.784364 | other | Cs16Te112 | 128 | 130 | 5,105.22 |
mp-1199235 | -8.459758 | -5.807757 | 6.187315 | other | La20Ir12 | 32 | 130 | 866.95 |
mp-1198712 | -8.86969 | -6.047865 | 6.500708 | other | Y20Ir12 | 32 | 130 | 756.44 |
mp-21538 | -5.214552 | -6.767376 | 3.5474 | other | Ba20Ge12 | 32 | 130 | 1,235.6 |
mp-1197997 | -9.086992 | -5.909021 | 6.497288 | other | Ho20Ir12 | 32 | 130 | 734.36 |
mp-650328 | -5.645461 | -2.291532 | -1.54979 | other | Nb12Te48 | 60 | 130 | 1,799.53 |
mp-568220 | -5.635556 | -2.330941 | -1.566197 | other | Nb24Te96 | 120 | 130 | 3,684.19 |
mp-1201266 | -8.95469 | -5.877805 | 6.431052 | other | Tb20Ir12 | 32 | 130 | 755.55 |
mp-30522 | -8.700025 | -6.208451 | 6.512075 | other | Nd20Ir12 | 32 | 130 | 827.91 |
mp-672217 | -7.375418 | -6.287213 | 6.016417 | other | La20Ga12 | 32 | 130 | 961.07 |
mp-669320 | -3.90838 | -5.915701 | 5.092702 | other | Ba20Si12 | 32 | 130 | 1,214.44 |
mp-672256 | -7.80925 | -6.252332 | 6.208424 | other | Y20Ga12 | 32 | 130 | 827.98 |
mp-1210280 | -4.50698 | -1.224626 | -3.040174 | other | Nb12Se48 | 60 | 130 | 1,420.28 |
mp-202 | -5.673244 | -2.389728 | -1.496741 | other | Ta12Te48 | 60 | 130 | 1,823.57 |
mp-1205021 | -8.698447 | -6.199203 | 6.538184 | other | Pr20Ir12 | 32 | 130 | 847.08 |
mp-680259 | -5.666088 | -2.410012 | -1.506312 | other | Ta24Te96 | 120 | 130 | 3,682.75 |
mp-21658 | -7.928783 | -6.516328 | 6.436216 | other | Sm20Ga12 | 32 | 130 | 869.84 |
mp-1201760 | -9.104188 | -5.779714 | 6.331133 | other | Er20Ir12 | 32 | 130 | 723.19 |
mp-1196886 | -8.069475 | -6.17466 | 6.321027 | other | Ho20Ga12 | 32 | 130 | 799.13 |
mp-1198195 | -9.083837 | -5.999795 | 6.541098 | other | Tm20Ir12 | 32 | 130 | 713.58 |
mp-18773 | 10.673129 | 11.172165 | -3.065236 | other | W4O12 | 16 | 130 | 216.61 |
mp-681150 | -6.184812 | -4.36142 | 3.10282 | other | Pu20Rh12 | 32 | 130 | 701 |
mp-850009 | -5.188066 | -0.898346 | -4.261909 | other | Fe4S8 | 12 | 13 | 209.47 |
mp-649605 | 11.013342 | 11.219736 | -2.883224 | other | W50O146 | 196 | 13 | 2,839.33 |
mp-1197211 | 9.08759 | 10.034513 | -2.149021 | other | Sb18O48 | 66 | 13 | 861.89 |
mp-1042656 | 11.795193 | 11.25002 | -2.158661 | other | W6O16 | 22 | 13 | 286.2 |
mp-1213423 | -4.984921 | -5.060628 | 0.379091 | other | Eu16As24 | 40 | 13 | 1,053.48 |
mp-1205212 | 8.259577 | 1.990725 | -1.249927 | other | B128F192 | 320 | 13 | 4,710.76 |
mp-32625 | 1.982694 | 2.945226 | -4.430696 | other | Mo6Cl24 | 30 | 13 | 795.13 |
mp-569175 | 1.625178 | 2.265275 | -4.726751 | other | Zr2Cl8 | 10 | 13 | 291.86 |
mp-645339 | -7.060369 | 0.644516 | 3.448166 | other | Fe20C8 | 28 | 13 | 259.57 |
mp-570763 | 2.017632 | 2.769326 | -4.451721 | other | V4Cl16 | 20 | 13 | 895.16 |
mp-1205379 | 3.550924 | -0.467913 | -2.523893 | other | Ge4H16 | 20 | 13 | 422.22 |
mp-1019078 | 0.847424 | 2.31329 | 1.672259 | other | Re2N4 | 6 | 13 | 57.16 |
mp-1080854 | -4.279315 | -4.976172 | -3.417414 | other | Ce18Se36 | 54 | 13 | 4,933.98 |
mp-27340 | 1.778187 | 2.687889 | -4.510449 | other | Re4Cl16 | 20 | 13 | 593.73 |
mp-27701 | 10.68073 | 10.67029 | -3.745069 | other | Mo18O52 | 70 | 13 | 1,052.14 |
mp-831269 | 9.953977 | 12.125094 | -4.294132 | other | V28O70 | 98 | 13 | 1,503.98 |
mp-1104544 | 10.904252 | 9.130729 | 0.249608 | other | Sn6O8 | 14 | 13 | 256.94 |
mp-1213665 | -5.647276 | -5.633427 | 0.676808 | other | Eu16Sb24 | 40 | 13 | 1,260.19 |
mp-560190 | 10.708523 | 10.67779 | -3.73106 | other | Mo32O92 | 124 | 13 | 1,858.32 |
mp-545488 | 13.658258 | 6.226621 | -0.648358 | other | Si4O8 | 12 | 13 | 167.83 |
mp-571235 | -1.173555 | 2.042957 | -2.496251 | other | Zr6I24 | 30 | 13 | 1,325.11 |
mp-759943 | 12.55111 | 7.539376 | 0.557155 | other | Al32O48 | 80 | 13 | 757.85 |
mp-706630 | 6.446266 | 0.315574 | -3.402733 | other | B40H56 | 96 | 13 | 846.84 |
mp-1227634 | -3.249348 | 1.718296 | 2.77915 | other | Be8B50 | 58 | 13 | 422.5 |
mp-28777 | 11.201892 | 10.846407 | -3.53745 | other | Mo18O50 | 68 | 13 | 1,086.84 |
mp-1098705 | -4.288367 | -4.962574 | -3.391171 | other | Ce4Se8 | 12 | 13 | 766.36 |
mp-31070 | -2.887797 | -0.834183 | -4.859579 | other | As16S18 | 34 | 13 | 924.89 |
mp-622497 | 12.947128 | 13.085726 | -1.126536 | other | V12O20 | 32 | 13 | 347.98 |
mp-29422 | 1.551892 | 2.264668 | -4.715359 | other | Hf2Cl8 | 10 | 13 | 288.51 |
mp-2669 | 10.717612 | 10.679518 | -3.727209 | other | Mo16O46 | 62 | 13 | 929.5 |
mp-31010 | -4.836168 | -5.16831 | 0.395878 | other | Ca16As24 | 40 | 13 | 966.16 |
mp-865511 | 1.975812 | 2.777643 | -4.39816 | other | V4Cl16 | 20 | 13 | 630.5 |
mp-560155 | 15.637763 | 5.655506 | 0.368451 | other | Si18O36 | 54 | 13 | 1,022.47 |
mp-1776732 | 5.891498 | 8.901601 | -1.846566 | other | Bi4O10 | 14 | 13 | 247.13 |
mp-999264 | 0.387057 | 2.152484 | 2.177412 | other | Re2N2 | 4 | 131 | 45.81 |
mp-1097032 | 0.688356 | 3.081809 | 1.543979 | other | Cr32N64 | 96 | 131 | 2,770.19 |
mp-600080 | 15.57651 | 5.661785 | 0.325948 | other | Si64O128 | 192 | 131 | 4,376.47 |
mp-999086 | 0.248088 | 2.148957 | 1.956191 | other | Tc2N2 | 4 | 131 | 45.24 |
mp-753682 | 11.896608 | 11.401196 | 0.066025 | other | Fe4O4 | 8 | 131 | 101.39 |
mp-1210339 | 4.284531 | 2.385166 | -3.198174 | other | Ni4C16 | 20 | 131 | 374.48 |
mp-697179 | 2.617859 | -0.401542 | -1.539969 | other | Zr4H4 | 8 | 131 | 104.72 |
mp-1007660 | 0.790662 | 2.19585 | 1.602 | other | Ir2N2 | 4 | 131 | 45.53 |
mp-2803876 | 7.29934 | 9.714597 | -1.683025 | other | Ag2O2 | 4 | 131 | 61.12 |
mp-600002 | 15.674905 | 5.635302 | 0.40198 | other | Si8O16 | 24 | 131 | 449.91 |
mp-554755 | 15.584124 | 5.66046 | 0.3308 | other | Si32O64 | 96 | 131 | 2,179.06 |
mp-755073 | 12.171889 | 12.219731 | 0.349821 | other | Cr4O4 | 8 | 131 | 94.07 |
mp-1080637 | -4.276056 | -4.971553 | -3.418055 | other | Ce32Se64 | 96 | 131 | 10,887.91 |
mp-1019097 | -1.088161 | 0.937994 | 1.7176 | other | Si2C4 | 6 | 131 | 69.83 |
mp-1214775 | -0.198355 | 1.420831 | -4.201602 | other | Au2Br4 | 6 | 131 | 234.45 |
mp-1430841 | 1.180994 | 2.390594 | 0.084067 | other | Ni2N2 | 4 | 131 | 54.22 |
mp-1214760 | -0.645942 | 2.418251 | -3.44779 | other | Au2I4 | 6 | 131 | 261.51 |
mp-677074 | 9.639961 | 8.38078 | -0.559422 | other | Pb2O2 | 4 | 131 | 88.53 |
mp-1692 | 7.561056 | 10.683094 | -0.962771 | other | Cu2O2 | 4 | 131 | 42.92 |
mp-7947 | 7.776029 | 11.065264 | -1.075403 | other | Pt2O2 | 4 | 131 | 53.46 |
mp-1417269 | 0.059981 | 2.794365 | 1.481555 | other | Fe2N2 | 4 | 131 | 56.35 |
mp-1336 | 7.827969 | 10.813255 | -0.851312 | other | Pd2O2 | 4 | 131 | 50.08 |
mp-690760 | 2.661998 | -0.258711 | -1.526517 | other | Ti4H4 | 8 | 131 | 79.37 |
mp-288 | -4.194002 | -1.40674 | -4.338891 | other | Pt2S2 | 4 | 131 | 74.69 |
mp-570108 | -2.274024 | 0.568622 | 2.358314 | other | Th2C4 | 6 | 131 | 96.42 |
mp-639480 | 15.724757 | 5.606848 | 0.425757 | other | Si18O36 | 54 | 131 | 1,074.28 |
mp-999307 | 0.372491 | 2.219104 | 1.951264 | other | Os2N2 | 4 | 131 | 44.75 |
mp-999293 | 0.884887 | 2.240087 | 1.22138 | other | Pd2N2 | 4 | 131 | 49.19 |
mp-1079127 | 2.761467 | -0.348886 | -1.660997 | other | Ti4H6 | 10 | 132 | 82.72 |
mp-20652 | 8.338737 | 1.294892 | -0.314457 | other | Pb4F12 | 16 | 132 | 253.37 |
mp-1080122 | 9.42245 | 8.665795 | -0.462493 | other | Bi4O6 | 10 | 132 | 173.6 |
mp-1080341 | -4.270964 | -4.946779 | -3.401277 | other | Ce8Se16 | 24 | 132 | 1,645.01 |
mp-554665 | 15.112739 | 5.76943 | 0.051678 | other | Si8O16 | 24 | 132 | 377 |
mp-680580 | -4.935905 | -4.748023 | 0.007256 | other | Zn96As64 | 160 | 133 | 3,390.63 |
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