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-1177647 | 6.172729 | 12.947968 | -1.426762 | other | Li9Ni21O36 | 66 | 1 | 616.46 |
mp-757065 | 9.173484 | 10.685514 | -1.669855 | other | Mn1Sb4O12 | 17 | 1 | 210.29 |
mp-626542 | 8.579148 | 3.95669 | -4.303576 | other | H12N4O4 | 20 | 1 | 233.58 |
mp-685371 | -5.720676 | -3.49312 | -2.112941 | other | Ge9Sb10Te24 | 43 | 1 | 1,413.54 |
mp-675021 | 11.527436 | 9.22123 | 2.820695 | other | Nd16Zr16O49 | 81 | 1 | 1,209.58 |
mp-1234693 | 9.355753 | 13.048515 | -0.957542 | other | Ca1Fe8O12 | 21 | 1 | 255.31 |
mp-863430 | 10.211903 | 9.085251 | 0.156759 | other | Zn12In8O24 | 44 | 1 | 580.72 |
mp-667309 | 8.677888 | 6.778075 | -3.851932 | other | Li12Se6O24 | 42 | 1 | 682.1 |
mp-762679 | 9.88181 | 9.776273 | -1.981071 | other | V2Te8O24 | 34 | 1 | 480.97 |
mp-2241510 | 11.537514 | 10.902189 | -3.240828 | other | Mg1Mo4O12 | 17 | 1 | 270.34 |
mp-753067 | 13.107979 | 0.62933 | 1.69342 | other | Fe8O6F10 | 24 | 1 | 286.6 |
mp-774380 | 10.75377 | 0.703296 | -0.972187 | other | Co10O5F15 | 30 | 1 | 345.59 |
mp-1180125 | 6.807267 | 5.93258 | -3.841115 | other | Ni1S1O9 | 11 | 1 | 183.14 |
mp-1188270 | 7.975185 | 5.514832 | -5.229819 | other | Gd2S3O12 | 17 | 1 | 287.28 |
mp-672212 | 10.986936 | 11.916018 | 2.769015 | other | Na1Nb13O33 | 47 | 1 | 695.02 |
mp-1221491 | -6.980845 | 1.476753 | -3.950749 | other | Mo4Ru2Se8 | 14 | 1 | 305.87 |
mp-676414 | 12.290442 | 9.203753 | 1.69007 | other | Al4C1O1 | 6 | 1 | 77.71 |
mp-807503 | 8.245957 | 4.524322 | -1.307896 | other | Cr4O1F11 | 16 | 1 | 198.67 |
mp-1245166 | 9.113204 | 13.075027 | -1.253731 | other | Cr4Fe28O48 | 80 | 1 | 981.56 |
mp-674374 | 10.13836 | 9.656043 | 0.073822 | other | In11Sb3O24 | 38 | 1 | 467.26 |
mp-776958 | 8.591278 | 15.185108 | -1.625074 | other | Mn8O13F3 | 24 | 1 | 248 |
mp-889216 | 7.416114 | 6.007838 | -2.224323 | other | Mn6O10F2 | 18 | 1 | 186.51 |
mp-34015 | 7.474854 | 13.022075 | -0.977499 | other | Mg10Fe9O24 | 43 | 1 | 469.93 |
mp-771838 | 11.527463 | 7.792048 | 1.677481 | other | La8Al12O30 | 50 | 1 | 695.22 |
mp-752772 | 8.082004 | 4.97827 | -6.594289 | other | Co4C6O18 | 28 | 1 | 340.5 |
mp-1247922 | 6.294155 | 0.137727 | -3.548923 | other | B40H51F3 | 94 | 1 | 780.53 |
mp-1386624 | 9.108359 | 1.916285 | 1.339192 | other | Zn2Sn2F8 | 12 | 1 | 170.38 |
mp-1379010 | 10.81041 | 9.028553 | 0.809099 | other | Ca4Sn4O8 | 16 | 1 | 269.87 |
mp-755787 | 10.935846 | 1.849264 | 2.484202 | other | Fe10O1F19 | 30 | 1 | 378.03 |
mp-767145 | 12.518347 | 12.384559 | -0.293256 | other | Mg8V5O16 | 29 | 1 | 308.55 |
mp-764575 | 12.250648 | -0.916438 | 0.905545 | other | Mn12O7F17 | 36 | 1 | 440.74 |
mp-1272285 | 5.650853 | 13.675598 | -1.664238 | other | Na8Co4O12 | 24 | 1 | 263.77 |
mp-775866 | 1.887235 | 1.769303 | 2.819772 | other | Zr16N16O8 | 40 | 1 | 523.07 |
mp-854026 | 7.581293 | 4.990367 | -1.698935 | other | Zr16N16O8 | 40 | 1 | 538.86 |
mp-760140 | 9.815058 | 1.798255 | 0.704183 | other | Li12V6F36 | 54 | 1 | 670.33 |
mp-625687 | 10.25714 | 3.065668 | -3.993515 | other | H36Br4O16 | 56 | 1 | 584.84 |
mp-849592 | 12.812851 | -1.141858 | 0.713868 | other | Mn12O10F14 | 36 | 1 | 421.09 |
mp-2219019 | 12.767154 | 13.330017 | -1.046256 | other | Mg1V4O8 | 13 | 1 | 153.61 |
mp-1179642 | 6.165006 | 5.214045 | -4.341441 | other | S4N8O16 | 28 | 1 | 632.25 |
mp-1223580 | -2.775616 | -2.355327 | -5.671256 | other | La12Sn5S28 | 45 | 1 | 1,132.17 |
mp-1100950 | 12.786716 | 12.47363 | -1.078369 | other | V17Pb3O32 | 52 | 1 | 640.4 |
mp-531611 | -3.403689 | 1.876564 | 2.786202 | other | Mg2Al4B56 | 62 | 1 | 485.07 |
mp-622628 | 6.715775 | 7.315697 | -2.609727 | other | Cu2Sb1O5 | 8 | 1 | 636.78 |
mp-803450 | 7.878435 | 5.262779 | -1.754069 | other | V4Cr4O12 | 20 | 1 | 210.12 |
mp-1639949 | 7.006656 | 19.626232 | -0.193679 | other | Li7Mn5O12 | 24 | 1 | 220.21 |
mp-753738 | 10.945112 | 12.475402 | -3.939976 | other | V3Co1O8 | 12 | 1 | 229.47 |
mp-1101683 | 13.103848 | 12.677573 | -0.692828 | other | Na1V5O8 | 14 | 1 | 165.49 |
mp-1097058 | 8.498116 | 14.995408 | -0.927414 | other | Li18Mn36O72 | 126 | 1 | 1,341.28 |
mp-779457 | 3.10691 | 2.6297 | 1.373717 | other | Ge8N8O4 | 20 | 1 | 273.62 |
mp-1042154 | 12.880363 | 10.216325 | 0.250536 | other | Zn4W8O16 | 28 | 1 | 381.96 |
mp-1219132 | -3.288092 | 0.653693 | -3.377555 | other | Re4Mo2Se8 | 14 | 1 | 303.2 |
mp-2216570 | 12.812505 | -0.839666 | 0.405096 | other | Mn8O8F8 | 24 | 1 | 273.37 |
mp-686055 | 9.530647 | 8.561623 | 2.912844 | other | Sr6Pr8O18 | 32 | 1 | 601.55 |
mp-675766 | 7.408599 | 5.067147 | -5.199216 | other | K4C1O6 | 11 | 1 | 215.98 |
mp-1281117 | 12.618185 | 12.177691 | 0.205937 | other | Nb4V4O16 | 24 | 1 | 309.69 |
mp-1233316 | 9.337366 | 13.264632 | -0.922894 | other | Mg1Fe8O12 | 21 | 1 | 228.01 |
mp-777061 | 12.90893 | -0.840194 | 0.359994 | other | Mn8O8F8 | 24 | 1 | 270.76 |
mp-1176450 | 12.745 | -1.071611 | 0.697303 | other | Mn12O10F14 | 36 | 1 | 420.25 |
mp-1176459 | 11.61186 | -0.277789 | 1.385087 | other | Mn6O2F10 | 18 | 1 | 232.3 |
mp-779788 | 7.992133 | 17.421228 | -0.108369 | other | Li12Mn12O24 | 48 | 1 | 452.58 |
mp-776214 | 1.682434 | 1.80584 | 2.953885 | other | Hf16N16O8 | 40 | 1 | 502.23 |
mp-1173458 | 6.582561 | 6.445187 | -3.313586 | other | Rb5N1O5 | 11 | 1 | 308.96 |
mp-757488 | 11.583841 | 12.750484 | 0.327943 | other | Ti9Fe11O30 | 50 | 1 | 545.33 |
mp-676002 | 8.380416 | 1.195351 | 1.85688 | other | Ba2Pr1F7 | 10 | 1 | 183.59 |
mp-807999 | 7.876899 | 5.258873 | -1.746171 | other | V4Cr4O12 | 20 | 1 | 209.83 |
mp-675309 | 11.584893 | 7.482574 | -3.576927 | other | Mg9As6O24 | 39 | 1 | 491.76 |
mp-699137 | 6.534137 | 14.037621 | -1.972543 | other | Li4Co7O14 | 25 | 1 | 249.26 |
mp-1236154 | 10.425338 | 12.440166 | -4.019819 | other | Li1V4O10 | 15 | 1 | 278.57 |
mp-625572 | 10.259175 | 3.045023 | -3.957241 | other | H20Br4O8 | 32 | 1 | 348.42 |
mp-1069726 | 3.288316 | 3.168907 | -3.87937 | other | Pd1N2Cl2 | 5 | 1 | 120.8 |
mp-685363 | 9.843632 | 9.320626 | -0.199963 | other | Cd18Sn19O56 | 93 | 1 | 1,404.12 |
mp-1225003 | -3.937033 | -1.416644 | -5.815436 | other | In20Sn12S42 | 74 | 1 | 1,713.57 |
mp-685351 | 11.1682 | 12.966227 | -0.021407 | other | Ti8Fe12O30 | 50 | 1 | 542.6 |
mp-39066 | 8.807851 | 2.115623 | 1.911593 | other | Cs2U4F18 | 24 | 1 | 410.97 |
mp-849292 | 13.602527 | 12.276538 | -3.341677 | original | V4O5F7 | 16 | 1 | 211.34 |
mp-2228983 | 10.836368 | 13.266229 | -3.57938 | other | Mg1V5O12 | 18 | 1 | 201.94 |
mp-685969 | -5.918455 | -3.183204 | -2.653518 | other | Ag8Ge1Te6 | 15 | 1 | 412.4 |
mp-1216122 | 10.451741 | 9.283114 | 3.689348 | other | Y4Zr3O12 | 19 | 1 | 248.84 |
mp-2229031 | 7.751116 | 10.060409 | -3.852518 | other | Mg1Cr4O12 | 17 | 1 | 295.46 |
mp-530870 | -2.640407 | -2.751898 | -5.60567 | other | Tb24Cd4S40 | 68 | 1 | 1,475 |
mp-531358 | -3.301748 | -1.422387 | -5.411282 | other | Sr17Ta10S42 | 69 | 1 | 1,844.19 |
mp-760240 | 11.882454 | -0.501267 | 1.084655 | other | Mn12O5F19 | 36 | 1 | 438.71 |
mp-675250 | 8.365906 | 1.4858 | 0.831254 | other | K2Bi4F14 | 20 | 1 | 358.66 |
mp-778904 | 12.714228 | -0.095736 | -0.054575 | other | Mn12O14F10 | 36 | 1 | 393.72 |
mp-673434 | 7.225306 | 5.904794 | -2.951861 | other | Mo2H4O8 | 14 | 1 | 164.96 |
mp-1199861 | 11.014192 | 8.082281 | -4.274318 | other | Ni6As6O21 | 33 | 1 | 394.06 |
mp-755330 | 11.826884 | 0.764066 | -0.176464 | other | Fe6O7F5 | 18 | 1 | 201.55 |
mp-1244876 | 10.335855 | 12.540298 | -1.434386 | other | Cr16Fe16O48 | 80 | 1 | 1,143.79 |
mp-2229060 | 11.710407 | 11.302562 | -2.215027 | other | Mg1W4O12 | 17 | 1 | 219.21 |
mp-756261 | 9.700707 | 1.01922 | -0.532184 | other | Ni6O2F10 | 18 | 1 | 205.36 |
mp-675470 | 10.453998 | 9.84034 | 4.04306 | other | Y1Zr9O20 | 30 | 1 | 352.59 |
mp-764751 | 12.735764 | -0.065416 | -0.054754 | other | Mn12O14F10 | 36 | 1 | 397 |
mp-2215792 | 9.226099 | 8.247296 | -5.978563 | other | Co4P8O28 | 40 | 1 | 478.44 |
mp-1173645 | 8.085534 | 10.286123 | 1.91252 | other | Pr8Ni4O17 | 29 | 1 | 424.7 |
mp-777314 | 2.526203 | 2.5593 | 1.135781 | other | Sn16N16O8 | 40 | 1 | 516.18 |
mp-729272 | 10.486545 | 9.355894 | -1.994265 | other | Tm4Te10O26 | 40 | 1 | 625.76 |
mp-781601 | 8.601523 | 15.206054 | -1.645965 | other | Mn8O13F3 | 24 | 1 | 245.85 |
mp-673402 | 11.220619 | 5.23903 | -4.062586 | other | Ga4H4O8 | 16 | 1 | 133.08 |
mp-35889 | 8.554819 | 5.441144 | -3.742009 | other | K4C2O3 | 9 | 1 | 187.36 |
mp-530780 | 11.624454 | 12.748407 | 0.372651 | other | Ti11Fe13O36 | 60 | 1 | 654.12 |
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