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-795950 | 7.318095 | 5.111361 | -2.036566 | other | Mo2H4O8 | 14 | 1 | 164.96 |
mp-685490 | 10.784753 | 9.284783 | 3.605477 | other | Hf15Sc20O60 | 95 | 1 | 1,124.84 |
mp-2216729 | 10.717084 | 12.755059 | 2.310957 | other | Ti6H4O14 | 24 | 1 | 287.36 |
mp-760821 | 8.4571 | 15.268232 | -0.497531 | other | Li6Mn8O16 | 30 | 1 | 289.84 |
mp-2220732 | 6.289782 | 13.528279 | -2.388672 | other | Mg1Co8O16 | 25 | 1 | 278.43 |
mp-1191944 | 8.802094 | 5.304833 | -5.580436 | other | S4I2O15 | 21 | 1 | 308.33 |
mp-676348 | -3.85722 | -1.104953 | -5.482716 | other | Nb1Ag7S6 | 14 | 1 | 320.2 |
mp-766237 | 9.975342 | 8.473847 | 3.128574 | other | Gd3Y13O24 | 40 | 1 | 603.16 |
mp-685434 | 8.181349 | 13.410925 | -0.696258 | other | Mg16Fe16O40 | 72 | 1 | 791.75 |
mp-755079 | 12.057163 | 3.085393 | 0.93243 | other | V4O3F9 | 16 | 1 | 196.64 |
mp-764087 | 12.523892 | 12.543306 | -3.910028 | other | V6O9F9 | 24 | 1 | 293.96 |
mp-675921 | 8.547312 | 2.119836 | 2.246312 | other | Ce3N1F6 | 10 | 1 | 149.64 |
mp-1236363 | 8.959755 | 13.431804 | -1.004949 | other | Li1Fe8O12 | 21 | 1 | 215.73 |
mp-626315 | 10.428061 | 3.761662 | -4.11544 | other | Sr2H32O20 | 54 | 1 | 460.68 |
mp-762590 | 8.028442 | 4.435103 | -6.975516 | other | Mn4C6O18 | 28 | 1 | 377.35 |
mp-674942 | 6.350806 | 5.459231 | -4.414624 | other | Na3N2O9 | 14 | 1 | 224.3 |
mp-850520 | 12.225983 | -0.928159 | 0.876904 | other | Mn12O7F17 | 36 | 1 | 441.58 |
mp-776392 | 5.796399 | 12.257159 | -1.422077 | other | Na4Ni6O14 | 24 | 1 | 274.06 |
mp-30187 | 10.472309 | 9.315664 | -2.04825 | other | Ga2Te4O11 | 17 | 1 | 250.03 |
mp-1175376 | 4.53185 | 19.068335 | -1.799736 | other | Li9Co7O16 | 32 | 1 | 278.46 |
mp-757370 | 10.296803 | 13.190146 | -0.572429 | other | Ti5Fe11O24 | 40 | 1 | 429.62 |
mp-2219448 | 12.422578 | 11.781151 | 1.9339 | other | Mg1Ti4O8 | 13 | 1 | 135.18 |
mp-698705 | 8.58199 | 14.991842 | -1.046737 | other | Li4Mn13O24 | 41 | 1 | 453.61 |
mp-676617 | 10.201733 | 8.785374 | -0.244684 | other | Ba5Bi14O21 | 40 | 1 | 794.11 |
mp-1379702 | 12.772985 | 12.206378 | -0.57836 | other | V4Zn4O8 | 16 | 1 | 190.12 |
mp-776365 | 8.555172 | 15.05003 | -0.881058 | other | Li9Mn21O40 | 70 | 1 | 755.47 |
mp-779739 | 1.685327 | 1.806208 | 2.946245 | other | Hf16N16O8 | 40 | 1 | 502.5 |
mp-775821 | 1.309929 | 1.874086 | 2.750587 | other | Ti16N16O8 | 40 | 1 | 427.75 |
mp-676411 | 11.073703 | 9.077347 | 2.037867 | other | Sr9U9O34 | 52 | 1 | 781.39 |
mp-675683 | -5.663059 | -3.617906 | -2.014401 | other | Yb3Sb14Te24 | 41 | 1 | 1,426.88 |
mp-530379 | 10.243813 | 9.722726 | 3.31401 | other | Tb16Ti8O40 | 64 | 1 | 869.07 |
mp-753891 | 10.561013 | 11.488508 | 3.063672 | other | Zr4Ti4O16 | 24 | 1 | 280.01 |
mp-1100951 | -4.305852 | -2.274359 | -3.354639 | other | V1Fe2Se4 | 7 | 1 | 593.12 |
mp-673678 | 9.15714 | 8.714051 | 1.617391 | other | Ba2In2O5 | 9 | 1 | 159.93 |
mp-780481 | 11.808327 | -0.540265 | 1.169636 | other | Mn12O5F19 | 36 | 1 | 454.84 |
mp-764701 | 9.952469 | 13.679527 | 0.184356 | other | Li8Mn5O10 | 23 | 1 | 232.23 |
mp-758028 | 10.996148 | 13.098293 | -3.366331 | other | Ca6V20O50 | 76 | 1 | 1,024.72 |
mp-760306 | 11.809134 | -0.516574 | 1.183591 | other | Mn12O5F19 | 36 | 1 | 454.15 |
mp-780763 | 11.403935 | 2.962564 | 1.317399 | other | V8O4F20 | 32 | 1 | 394.5 |
mp-1220915 | 8.564664 | 1.248017 | 1.888056 | other | Na3Sm3F12 | 18 | 1 | 227.25 |
mp-2232190 | 12.018157 | 11.377275 | 2.288562 | other | Mg1Nb4O10 | 15 | 1 | 185.33 |
mp-1235496 | 6.653902 | 6.072996 | -3.693929 | other | Sr2Li1O12 | 15 | 1 | 216.29 |
mp-1275592 | 12.556787 | 13.320724 | -1.179468 | other | Li4V10O20 | 34 | 1 | 384.99 |
mp-759257 | 12.75049 | -0.030529 | -0.038418 | other | Mn12O14F10 | 36 | 1 | 401.52 |
mp-763427 | 10.653413 | 12.66993 | -4.649656 | other | V4O7F5 | 16 | 1 | 207.76 |
mp-675214 | 8.324101 | 1.410083 | 0.904485 | other | Rb2Bi3F11 | 16 | 1 | 302.48 |
mp-625841 | 10.500484 | 3.703969 | -4.117136 | other | Sr2H32O20 | 54 | 1 | 464.73 |
mp-768357 | 10.588656 | 12.25143 | 2.311964 | other | Ba2Ti11O24 | 37 | 1 | 466.23 |
mp-1303638 | 10.617278 | 2.755087 | 1.465856 | other | V4O1F11 | 16 | 1 | 218.17 |
mp-675779 | -5.80655 | 1.374534 | -5.037136 | other | Li4Mo6S8 | 18 | 1 | 295.81 |
mp-1182247 | 10.668412 | 5.731169 | -4.313581 | other | Fe16H20O34 | 70 | 1 | 697.24 |
mp-754860 | 10.712968 | 0.723839 | -0.938451 | other | Co10O5F15 | 30 | 1 | 349.69 |
mp-675426 | 8.403259 | 1.255537 | 1.819825 | other | Ba3Pr1F9 | 13 | 1 | 235.8 |
mp-777793 | 10.497541 | 2.231479 | -0.204899 | other | V6O5F19 | 30 | 1 | 440.55 |
mp-675030 | 10.018453 | 13.065314 | 0.102106 | other | Ti8Ni8O24 | 40 | 1 | 414.19 |
mp-551451 | 9.174854 | 10.762827 | -1.169934 | other | Fe1Bi1O3 | 5 | 1 | 132.01 |
mp-1380123 | 8.372637 | 13.055405 | -0.66753 | other | Ca6Fe12O24 | 42 | 1 | 526.48 |
mp-754683 | 10.018518 | 12.124356 | -4.665257 | other | V6O12F6 | 24 | 1 | 300.81 |
mp-1223696 | -1.213474 | 2.401398 | -3.002452 | other | In2I4Br2 | 8 | 1 | 318.27 |
mp-863411 | 9.947738 | 12.426506 | -4.108979 | other | V18Ag7O48 | 73 | 1 | 970.93 |
mp-626291 | 10.440444 | 3.732578 | -4.140305 | other | Ca2H32O20 | 54 | 1 | 438.94 |
mp-686587 | -3.557035 | -2.020996 | -4.884019 | other | Yb18Fe12S40 | 70 | 1 | 1,735.35 |
mp-762932 | 6.076715 | 13.0779 | -1.394791 | other | Li4Ni5O10 | 19 | 1 | 181.88 |
mp-2217655 | 8.061728 | 9.146046 | -3.355325 | other | Mg1Ru2O8 | 11 | 1 | 217.29 |
mp-849606 | 10.09637 | 1.141543 | 0.299311 | other | Cr8O2F22 | 32 | 1 | 401.24 |
mp-1288387 | 11.393063 | 7.968212 | -4.651164 | other | Co4As4O14 | 22 | 1 | 258.08 |
mp-759319 | 5.247234 | 10.965182 | -2.197777 | other | Li6Fe10O24 | 40 | 1 | 429.41 |
mp-1224818 | -7.173751 | -3.563381 | 4.343664 | other | Hf12Ga15Ni9 | 36 | 1 | 579.21 |
mp-626014 | 8.960191 | 5.112828 | -4.075876 | other | H20I4O24 | 48 | 1 | 474.55 |
mp-1233473 | 6.420049 | 13.408847 | -2.335572 | other | Ca1Co8O16 | 25 | 1 | 301.14 |
mp-690538 | 10.161834 | 8.233045 | -4.781741 | other | Co9As6O24 | 39 | 1 | 492.86 |
mp-698627 | 10.327073 | 13.18654 | -0.568822 | other | Ti5Fe11O24 | 40 | 1 | 432.71 |
mp-779538 | 5.491369 | 12.279887 | -2.452786 | other | Fe10O14F6 | 30 | 1 | 332.54 |
mp-755806 | 5.181013 | 10.798925 | -2.179789 | other | Li3Fe5O12 | 20 | 1 | 197.02 |
mp-1173689 | 8.77593 | 9.789557 | -0.057129 | other | Na8Pt1O6 | 15 | 1 | 217.05 |
mp-1221406 | 8.586309 | 0.905991 | 0.83683 | other | Na3Eu3F12 | 18 | 1 | 249.6 |
mp-755729 | 11.897629 | 0.745491 | -0.139611 | other | Fe6O7F5 | 18 | 1 | 204.32 |
mp-625860 | 10.488513 | 3.694349 | -4.114406 | other | Sr2H32O20 | 54 | 1 | 465.35 |
mp-766404 | 7.013627 | 9.757886 | 0.685289 | other | Ba8Cu8O19 | 35 | 1 | 536.25 |
mp-2215234 | 11.61568 | 12.582694 | -3.356527 | other | V5Fe1O12 | 18 | 1 | 258.01 |
mp-2219818 | 12.472419 | 11.549951 | 1.924601 | other | Mg1Ti4O8 | 13 | 1 | 159.1 |
mp-1100873 | -4.333717 | -3.921576 | -3.9609 | other | Y2Ag2Se4 | 8 | 1 | 199.28 |
mp-850940 | 11.808589 | -0.542674 | 1.170986 | other | Mn12O5F19 | 36 | 1 | 455.99 |
mp-766445 | 8.67117 | 14.538181 | -1.133446 | other | Mn8Co4O16 | 28 | 1 | 314.22 |
mp-1367192 | 10.361523 | 9.671452 | -0.613396 | other | Zn2Sb4O10 | 16 | 1 | 271.96 |
mp-26060 | 9.81069 | 8.261617 | -6.70192 | other | Mn9P12O48 | 69 | 1 | 845.81 |
mp-674464 | 10.541285 | 13.124543 | -0.47755 | other | Ti4Fe8O18 | 30 | 1 | 321.5 |
mp-780867 | 8.599299 | 15.189815 | -1.605246 | other | Mn8O13F3 | 24 | 1 | 247.8 |
mp-584116 | 10.588024 | 7.481277 | -4.094042 | other | Bi3P2O10 | 15 | 1 | 232.6 |
mp-850021 | 8.658737 | 13.187854 | -1.285905 | other | Na2Fe22O34 | 58 | 1 | 743.38 |
mp-685295 | 10.632157 | 10.167678 | 3.173965 | other | Sr22Nb10O47 | 79 | 1 | 1,353.26 |
mp-780624 | 10.493723 | 2.253744 | -0.201987 | other | V6O5F19 | 30 | 1 | 422.16 |
mp-1247867 | 10.193433 | 10.753394 | 1.134103 | other | Ba22W8O46 | 76 | 1 | 1,396.72 |
mp-1337287 | 8.288803 | 5.665387 | -1.62724 | other | V4Cr4O12 | 20 | 1 | 210.74 |
mp-627442 | 11.500094 | 4.481288 | -4.138737 | other | Ge7H18O23 | 48 | 1 | 489.68 |
mp-758590 | 9.476679 | 12.515299 | -4.220539 | other | Mn1V4O12 | 17 | 1 | 194.84 |
mp-767269 | 8.379033 | 13.537305 | -1.015952 | other | Ga7Fe9O24 | 40 | 1 | 438.26 |
mp-1178444 | 9.614739 | 10.84183 | -3.380888 | other | Cr1W3O12 | 16 | 1 | 213.85 |
mp-763943 | 15.086931 | 12.498929 | -0.803051 | other | V6O7F5 | 18 | 1 | 203.95 |
mp-1233223 | 11.840712 | 10.917674 | -2.552511 | other | Mg1Mo6O16 | 23 | 1 | 350.61 |
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