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-541878 | -3.441039 | -1.377125 | -5.521869 | other | K8Ge8S20 | 36 | 15 | 1,002.56 |
mp-758879 | 7.633897 | 6.14939 | -3.514379 | other | Fe2O4F2 | 8 | 15 | 93.09 |
mp-3922 | -3.609064 | -1.376569 | -5.398426 | other | Ag4Sb4S8 | 16 | 15 | 387.34 |
mp-754665 | 6.867691 | 6.093532 | -3.1927 | other | Pb2Br4O12 | 18 | 15 | 298.65 |
mp-768615 | 1.065576 | 1.655373 | -5.21745 | other | Sr6La4Cl24 | 34 | 15 | 1,045.65 |
mp-685608 | 8.863111 | 1.94744 | 1.879727 | other | K4U2F12 | 18 | 15 | 305.67 |
mp-769390 | 10.502746 | 10.908317 | 3.284561 | other | Ca6Ta4O16 | 26 | 15 | 376.06 |
mp-979418 | -4.722007 | 0.984786 | 3.363445 | other | Sm4Re6B12 | 22 | 15 | 270.23 |
mp-683910 | -2.600872 | -0.452791 | -5.436219 | other | Ag28P12S44 | 84 | 15 | 1,830.85 |
mp-1190542 | -7.944558 | -1.735915 | 2.878018 | other | Tb2Si6Ni16 | 24 | 15 | 294.23 |
mp-28779 | 11.484157 | 9.274534 | 1.144036 | other | U2Sb2O10 | 14 | 15 | 201.07 |
mp-1210513 | 2.571539 | 2.778012 | -3.728124 | other | Ni2I12N12 | 26 | 15 | 663.35 |
mp-768361 | -4.838418 | -0.910392 | -5.310214 | other | Li8Fe8S12 | 28 | 15 | 506.64 |
mp-753621 | -5.241019 | -4.010558 | -2.662292 | other | Li10Sb2S2 | 14 | 15 | 251.39 |
mp-1222550 | 8.847607 | 13.426626 | -1.039417 | other | Mg4Fe14O24 | 42 | 15 | 468.17 |
mp-759850 | 15.289017 | 12.446051 | -1.06601 | other | V4O4F6 | 14 | 15 | 165.26 |
mp-1211181 | 7.195652 | 6.219144 | -4.321023 | other | Na4P4O26 | 34 | 15 | 528.31 |
mp-1182246 | 8.814366 | 8.058667 | -2.463193 | other | Ba2Ge6O16 | 24 | 15 | 301.33 |
mp-1188815 | -2.932548 | -2.45824 | -4.292371 | other | U4Co2S10 | 16 | 15 | 294.61 |
mp-850283 | 12.021173 | 10.887094 | 2.712849 | other | Hf2Nb2O8 | 12 | 15 | 137.42 |
mp-4426 | 9.393458 | 6.485741 | -2.887918 | other | Li8Se2O10 | 20 | 15 | 190.71 |
mp-26214 | 9.259089 | 8.003485 | -5.550125 | other | Fe4P8O28 | 40 | 15 | 516.21 |
mp-1212217 | 6.830149 | 6.075777 | -3.936548 | other | Mg4As4O44 | 52 | 15 | 730.05 |
mp-1045679 | 10.316308 | 10.519243 | -1.019998 | other | Nb4Te2O16 | 22 | 15 | 325.99 |
mp-1246121 | 1.939107 | 1.940351 | 1.260082 | other | Ca6In4N8 | 18 | 15 | 289.93 |
mp-32527 | 12.666696 | 8.287313 | -7.358755 | other | V2P8O24 | 34 | 15 | 447.58 |
mp-1080432 | 7.961125 | 5.232874 | -4.283842 | other | K4Se4O2 | 10 | 15 | 253.44 |
mp-1003735 | 8.844539 | 14.773179 | -0.409916 | other | Mg4Mn8O16 | 28 | 15 | 311.97 |
mp-29894 | 11.305432 | 10.881438 | -2.680325 | other | Hg4W2O8 | 14 | 15 | 229.92 |
mp-18575 | 10.827382 | 11.705251 | 2.351444 | other | Nb4Zn6O16 | 26 | 15 | 305.36 |
mp-28871 | -1.168494 | 2.750517 | -3.101382 | other | In12Sn4I20 | 36 | 15 | 1,447.8 |
mp-772864 | 11.427409 | 7.398794 | -0.692582 | other | Rb8Ge8O20 | 36 | 15 | 739.08 |
mp-752677 | -0.126336 | 0.815939 | -3.714605 | other | Ba4Y2Br14 | 20 | 15 | 673.8 |
mp-1392416 | 9.433779 | 0.61481 | 0.578755 | other | Ca2Fe2F10 | 14 | 15 | 202.62 |
mp-1104701 | 8.50008 | 6.482436 | -5.931803 | other | Mn2S2O10 | 14 | 15 | 176.7 |
mp-1289249 | 13.695248 | 7.6357 | -0.983265 | other | Mn4Si4O12 | 20 | 15 | 230.97 |
mp-1246432 | 2.381816 | 2.270786 | 1.604003 | other | Ga4Ge6N8 | 18 | 15 | 255.47 |
mp-1186251 | -7.85138 | -2.730418 | 5.271912 | other | Nd4Co6Ge10 | 20 | 15 | 341.25 |
mp-3496 | 5.460573 | 3.625892 | -4.105433 | other | S6N4O4 | 14 | 15 | 300.22 |
mp-754521 | 7.605199 | 6.558196 | -2.903262 | other | Sr2I4O12 | 18 | 15 | 302.07 |
mp-1209080 | 1.573279 | 2.581882 | -4.778325 | other | Rb2Ta2Cl12 | 16 | 15 | 454.95 |
mp-29177 | 8.425651 | 1.83519 | -0.52397 | other | Ba2Te4F20 | 26 | 15 | 394.17 |
mp-542387 | -5.314663 | -6.164135 | 0.710135 | other | Na24Tl4Sb16 | 44 | 15 | 1,322.53 |
mp-29375 | -3.658113 | -1.687554 | -5.606377 | other | Na12In4S12 | 28 | 15 | 698.88 |
mp-1246363 | 2.163793 | 2.322122 | 1.294746 | other | Ga4Bi8N12 | 24 | 15 | 449.19 |
mp-540658 | 8.508316 | 12.679646 | -1.072368 | other | Na6Fe10O18 | 34 | 15 | 422.67 |
mp-1143109 | 10.890082 | 8.056125 | -3.520619 | other | Si8Mo4O28 | 40 | 15 | 583.81 |
mp-17714 | 13.744336 | 4.408025 | -1.713945 | other | Ho8B12O30 | 50 | 15 | 483.49 |
mp-12263 | 8.75196 | 1.378563 | -0.407382 | other | Li4Au4F16 | 24 | 15 | 302.63 |
mp-17245 | 8.801601 | 1.32891 | 1.095858 | other | Na6Ta2F16 | 24 | 15 | 288.58 |
mp-1389691 | 9.29035 | 0.701095 | -0.2309 | other | Ca2Ni2F10 | 14 | 15 | 195.99 |
mp-14128 | 8.578932 | 1.293512 | 1.448371 | other | K4Hf2F12 | 18 | 15 | 252.52 |
mp-676103 | 6.812963 | 5.758797 | -3.274232 | other | Rb2Cl2O8 | 12 | 15 | 140.67 |
mp-1211264 | 1.625221 | 2.912368 | -4.778979 | other | K2W2Cl12 | 16 | 15 | 429.3 |
mp-1247149 | 1.77639 | 1.808565 | 1.508205 | other | Sr10Zr4N12 | 26 | 15 | 541.46 |
mp-1104369 | 12.739894 | 13.29161 | -0.964088 | other | Na2V4O8 | 14 | 15 | 176.07 |
mp-1247395 | 3.00673 | 2.344189 | 0.420872 | other | Ca10C4N12 | 26 | 15 | 329.15 |
mp-22737 | -3.455369 | -1.456693 | -5.286606 | other | Sb16Pb6S30 | 52 | 15 | 1,409.08 |
mp-761184 | 9.989888 | 9.448508 | 0.325069 | other | Na8Sn4O12 | 24 | 15 | 287.45 |
mp-766396 | 13.290421 | 6.6868 | -7.031171 | other | Ti2P8O24 | 34 | 15 | 445.69 |
mp-38407 | -4.849801 | -5.320552 | 0.482384 | other | Li10Si2As6 | 18 | 15 | 325.67 |
mp-753130 | 9.696034 | 0.480488 | 0.119081 | other | Li8Cu2F14 | 24 | 15 | 286.71 |
mp-770799 | 10.035014 | 11.972604 | 0.790539 | other | Li10Nb2O10 | 22 | 15 | 237.83 |
mp-1379381 | 12.355967 | 7.842271 | -2.722165 | other | Si8W4O28 | 40 | 15 | 596.22 |
mp-1216303 | 10.14906 | 9.196776 | -6.35964 | other | V2P2O10 | 14 | 15 | 169.18 |
mp-19913 | -3.160967 | -4.495627 | 0.864671 | other | Ba6In4P8 | 18 | 15 | 552.35 |
mp-1188510 | 8.176669 | 1.620826 | 0.575129 | other | Cs2Sb4F14 | 20 | 15 | 458.34 |
mp-772627 | 11.355959 | 11.228368 | -2.576831 | other | Ho4W6O24 | 34 | 15 | 477.28 |
mp-989631 | 0.834112 | 2.588936 | 1.774848 | other | La4Mo4N12 | 20 | 15 | 326.46 |
mp-1245644 | 0.595047 | 2.548383 | 1.750688 | other | Ga4Co8N12 | 24 | 15 | 262.7 |
mp-1103845 | 8.191059 | 6.648203 | -5.545033 | other | Co2S2O10 | 14 | 15 | 174.25 |
mp-674503 | 8.178102 | 1.997464 | -0.200329 | other | Hg4Sb2F12 | 18 | 15 | 350.08 |
mp-1211791 | 7.610823 | 7.218458 | -4.420019 | other | Lu4S6O40 | 50 | 15 | 775.29 |
mp-1247122 | 0.96554 | 2.158896 | 1.64355 | other | Ba6Mn4N8 | 18 | 15 | 316.63 |
mp-626241 | 10.466044 | 3.710519 | -4.090638 | other | Sr2H32O20 | 54 | 15 | 458.59 |
mp-580999 | 1.841243 | 2.513047 | -4.989523 | other | Ga4Ni2Cl16 | 22 | 15 | 589.01 |
mp-1101098 | -5.755981 | -2.316453 | -1.415835 | other | Ti8Cr2Te16 | 26 | 15 | 661.27 |
mp-754405 | 11.555231 | 9.363413 | 2.474548 | other | Ce4Ti2O10 | 16 | 15 | 228.92 |
mp-18607 | 10.557623 | 9.527081 | -2.039049 | other | Mn4Te6O16 | 26 | 15 | 405.51 |
mp-977298 | 3.448322 | -0.642429 | -2.254663 | other | Li4Be4H12 | 20 | 15 | 154.36 |
mp-1245422 | 0.542011 | 2.433964 | 1.83701 | other | Mn8Ru4N12 | 24 | 15 | 243.85 |
mp-3978 | 12.663281 | 6.316223 | -0.234653 | other | Sr6Si6O18 | 30 | 15 | 447.86 |
mp-1046509 | 8.805028 | 12.794538 | -1.994007 | other | Mn10Te6O36 | 52 | 15 | 647.11 |
mp-28136 | 8.813784 | 8.283818 | -1.727291 | other | Hg8I4O4 | 16 | 15 | 422.21 |
mp-1246041 | 2.298601 | 2.122477 | 1.748251 | other | Mg6Ga4N8 | 18 | 15 | 204.13 |
mp-831182 | 10.068962 | 10.226419 | 0.100121 | other | Na14Cr4O12 | 30 | 15 | 451.36 |
mp-18108 | 13.711352 | 4.434016 | -1.82736 | other | Dy8B12O30 | 50 | 15 | 488.09 |
mp-642227 | -3.407702 | -1.550955 | -5.323244 | other | Sb16Pb10S34 | 60 | 15 | 1,616.12 |
mp-755199 | 13.758823 | 9.344754 | -1.08039 | other | V4Ge4O12 | 20 | 15 | 239.23 |
mp-1190160 | 8.92658 | 6.796201 | -3.632695 | other | K4Se4O14 | 22 | 15 | 361.71 |
mp-761686 | 6.408916 | 8.90939 | -0.497694 | other | Na8Bi4O12 | 24 | 15 | 329.13 |
mp-675299 | 12.367058 | 6.395629 | 0.021667 | other | Ca8Si4O16 | 28 | 15 | 375.7 |
mp-4907 | -3.512307 | -1.640832 | -5.571473 | other | Na12Sn4S14 | 30 | 15 | 737.5 |
mp-1246828 | 2.259922 | 1.811889 | 1.787157 | other | Y8Sc4N12 | 24 | 15 | 377.64 |
mp-769213 | 8.98138 | 6.851048 | -3.968809 | other | Dy4Se6O24 | 34 | 15 | 428.5 |
mp-1201377 | 6.263545 | 4.99855 | -4.682518 | other | Pr8N24O72 | 104 | 15 | 1,418.49 |
mp-1029801 | 0.823035 | 2.516873 | 1.67158 | other | Cs4Mn8N12 | 24 | 15 | 519.79 |
mp-1245624 | 0.857069 | 2.194564 | 1.730423 | other | Ca6Os4N8 | 18 | 15 | 256.43 |
mp-541895 | -3.140046 | 0.88406 | -3.901922 | other | Na8Re12S24 | 44 | 15 | 888.56 |
mp-757078 | 11.183709 | 12.48268 | -3.767884 | other | V4Fe2O12 | 18 | 15 | 239.27 |
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