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-777443 | 9.585145 | 0.686591 | -0.37111 | other | Li6Fe3F18 | 27 | 12 | 297.65 |
mp-573891 | -4.657526 | -2.874678 | -4.01164 | other | K4Ag8Se6 | 18 | 12 | 452.01 |
mp-1397700 | 6.740047 | 12.594429 | -1.187968 | other | Ca2Ni4O8 | 14 | 12 | 161.13 |
mp-1225233 | -6.677205 | -6.643704 | 3.186562 | other | Eu2Zn2Sn2 | 6 | 12 | 152.81 |
mp-754730 | -1.188607 | 1.990313 | -1.876523 | other | Sr4Ca4I16 | 24 | 12 | 1,260.09 |
mp-1246821 | 1.586843 | 1.815068 | 1.34173 | other | Sr8Ni3N8 | 19 | 12 | 353.2 |
mp-571055 | -6.683271 | 0.239929 | 3.440213 | other | Fe11Mo6C5 | 22 | 12 | 237.2 |
mp-570292 | -2.517359 | 0.541969 | 2.427149 | other | La7Os4C9 | 20 | 12 | 365.57 |
mp-1217454 | -7.015855 | -0.939119 | 4.534111 | other | Th2Mn17C2 | 21 | 12 | 324.25 |
mp-1103379 | -4.709801 | -3.000284 | -3.72167 | other | Cs4Sn2Se6 | 12 | 12 | 495.52 |
mp-1384862 | 0.717309 | 2.75214 | 1.778906 | other | Zn4W2N4 | 10 | 12 | 139.09 |
mp-1105097 | -4.119502 | -0.079826 | -4.463889 | other | Ti4Co1S8 | 13 | 12 | 229.61 |
mp-1213793 | 7.412666 | 7.889795 | -3.91014 | other | Co3P2O16 | 21 | 12 | 251.88 |
mp-760843 | 8.070609 | 14.502712 | -1.091046 | other | Na11Mn13O32 | 56 | 12 | 659.08 |
mp-540757 | 9.763682 | 12.244802 | -3.948992 | other | V2Cu1O6 | 9 | 12 | 97.33 |
mp-754870 | 7.977499 | 13.149747 | -0.780455 | other | Li4Rh2O6 | 12 | 12 | 105.63 |
mp-16909 | 10.995689 | 10.800604 | -3.588094 | other | K2Mo6O18 | 26 | 12 | 389.96 |
mp-1025344 | -6.419388 | -2.456388 | -1.664787 | other | V1Cr2Te4 | 7 | 12 | 171.72 |
mp-1225215 | -7.80591 | -6.092236 | 4.102308 | other | Eu2Ga2Cu2 | 6 | 12 | 123.53 |
mp-505149 | -5.321926 | -1.759995 | -3.714502 | other | Cs1Cr5Se8 | 14 | 12 | 314.02 |
mp-28755 | -0.603976 | 0.725852 | -2.432558 | other | Gd2C2Br2 | 6 | 12 | 138.1 |
mp-779328 | 7.34713 | 11.109898 | -0.800124 | other | Na2Cu4O6 | 12 | 12 | 122.7 |
mp-1047307 | 11.122682 | 9.403488 | 0.255626 | other | Zn2Sn4O8 | 14 | 12 | 205.02 |
mp-1104042 | -4.838409 | -5.079429 | 0.373053 | other | Sr4Zn4As6 | 14 | 12 | 336.4 |
mp-1199550 | -8.824078 | -0.191476 | 2.550745 | other | Y3Ni19B10 | 32 | 12 | 329.75 |
mp-4847 | -7.271168 | -3.472264 | 5.91845 | other | Y4Al23Ni6 | 33 | 12 | 533.94 |
mp-680610 | -8.332922 | -5.413755 | 3.395203 | other | Pr4In21Pd10 | 35 | 12 | 774.5 |
mp-1232615 | -5.984312 | -5.678279 | 0.659111 | other | Ba2Mn4Bi4 | 10 | 12 | 299.05 |
mp-570723 | -4.748228 | -4.314508 | 5.464324 | other | La10Si10I6 | 26 | 12 | 769.44 |
mp-1216467 | -6.626383 | -5.626046 | 3.945245 | other | Yb20Zn30Ge31 | 81 | 12 | 1,610.85 |
mp-31874 | 10.639684 | 7.893034 | -6.917731 | other | Fe2P8O24 | 34 | 12 | 533.52 |
mp-752549 | 9.316115 | 0.677655 | 0.624876 | other | Li1Ag1F2 | 4 | 12 | 48.9 |
mp-1203078 | -2.689399 | -2.804709 | -5.45137 | other | Sm4Er11S22 | 37 | 12 | 864.25 |
mp-1193196 | -0.577659 | 1.45161 | -3.998994 | other | Re6Br18O4 | 28 | 12 | 808.54 |
mp-754047 | 9.338348 | 8.534919 | -0.041696 | other | Rb6Sb2O6 | 14 | 12 | 353.54 |
mp-1197806 | 8.892001 | 10.678104 | 1.124556 | other | Ba16Re6O37 | 59 | 12 | 996.77 |
mp-1226571 | -3.01047 | -3.778428 | -3.399097 | other | Ce1Sm3S4 | 8 | 12 | 184.42 |
mp-1410375 | 11.72759 | 11.531919 | 0.206551 | other | Mg4Fe4O8 | 16 | 12 | 197.14 |
mp-777595 | 10.072694 | 0.621371 | 0.360186 | other | Li2Fe2F8 | 12 | 12 | 161.79 |
mp-1276673 | 13.098413 | 12.122218 | -0.199404 | other | Al4V8O16 | 28 | 12 | 298.45 |
mp-1399347 | 1.013989 | 2.402811 | 1.749842 | other | Zn4Co2N4 | 10 | 12 | 124.39 |
mp-1402980 | 6.8595 | 13.731868 | -1.935551 | other | Mg2Co4O8 | 14 | 12 | 134.27 |
mp-759338 | 9.811938 | 14.955777 | -1.336211 | other | Mn6O8F4 | 18 | 12 | 196.91 |
mp-7657 | -5.825205 | -3.574346 | -1.868039 | other | K6Si2Te6 | 14 | 12 | 528.41 |
mp-1225775 | -7.689671 | 1.026207 | 4.833888 | other | Er2Fe17C2 | 21 | 12 | 264.37 |
mp-1228765 | -8.181412 | -6.691243 | 4.487842 | other | Er2Tl2Cu2 | 6 | 12 | 143.74 |
mp-1227096 | -7.750463 | -5.966697 | 4.100363 | other | Ca2Ga2Cu2 | 6 | 12 | 117.37 |
mp-1412190 | 1.159154 | 2.419251 | 1.85279 | other | Mg4Co2N4 | 10 | 12 | 117.74 |
mp-1400735 | 10.731232 | 9.652241 | -0.046749 | other | Mg2Sb3O8 | 13 | 12 | 180.09 |
mp-759854 | 10.209787 | 12.801018 | -0.346802 | other | Na5Fe11O16 | 32 | 12 | 335.43 |
mp-505397 | 1.399085 | 2.308106 | -5.654803 | other | K2Pu1Cl6 | 9 | 12 | 290.07 |
mp-755874 | 6.572904 | 17.705452 | -0.540944 | other | Na4Mn2O6 | 12 | 12 | 122.54 |
mp-18988 | 6.874277 | 17.828773 | -0.578842 | other | Li8Mn4O12 | 24 | 12 | 195.47 |
mp-676553 | -1.179173 | 2.944529 | -2.88386 | other | Rb2Cr2I6 | 10 | 12 | 396.64 |
mp-690644 | -3.604109 | -1.427158 | -5.55138 | other | Tl1In1S2 | 4 | 12 | 133.69 |
mp-1232146 | -4.615931 | -3.575097 | -3.759004 | other | Yb4Mg4Se12 | 20 | 12 | 593.33 |
mp-754866 | 10.675829 | 0.733754 | -1.02169 | other | Co8O4F12 | 24 | 12 | 281.53 |
mp-757064 | 8.421215 | 14.285105 | -1.572133 | other | Ti1Mn5O12 | 18 | 12 | 217.19 |
mp-559631 | 8.619272 | 11.359529 | -0.731495 | other | Bi12Rh24O58 | 94 | 12 | 1,204.53 |
mp-1273062 | 10.740188 | 4.620075 | -4.177443 | other | Co2H4O4 | 10 | 12 | 85.73 |
mp-726396 | 2.55227 | 2.920271 | -4.015473 | other | Sb2N4Cl10 | 16 | 12 | 570.94 |
mp-1100881 | 10.807908 | 11.553739 | 3.333132 | other | Y2Ta6O18 | 26 | 12 | 371.13 |
mp-29062 | 8.555284 | 1.417395 | 1.181468 | other | Th2Zr4F24 | 30 | 12 | 411.05 |
mp-29618 | -5.600225 | -1.055622 | 2.21466 | other | Ni2P6W4 | 12 | 12 | 170.19 |
mp-1178487 | 9.547933 | 8.522102 | -0.563431 | other | Bi10O14F2 | 26 | 12 | 505.64 |
mp-1175514 | 4.147035 | 19.617611 | -1.793653 | other | Li9Co7O16 | 32 | 12 | 287.35 |
mp-1174652 | 5.378596 | 20.738726 | -0.645519 | other | Li5Mn3O8 | 16 | 12 | 154.32 |
mp-530879 | 12.138659 | 9.669682 | 2.115181 | other | Ba12Ti12O27 | 51 | 12 | 798.57 |
mp-1097885 | 6.622488 | 15.259159 | -1.572964 | other | Li4Co4O8 | 16 | 12 | 138.98 |
mp-1196484 | -2.637865 | -2.820893 | -5.483811 | other | Pr4Er11S22 | 37 | 12 | 878.51 |
mp-22754 | 11.005201 | 8.091928 | -4.222942 | other | Ni4As4O14 | 22 | 12 | 264.73 |
mp-861577 | 11.222645 | 13.784917 | -1.244972 | other | Li8V4O12 | 24 | 12 | 216.17 |
mp-1221438 | 6.401266 | 13.87944 | -2.136897 | original | Na2Co6O12 | 20 | 12 | 222.35 |
mp-779455 | 12.000669 | 12.436576 | 1.132707 | other | Li7Ti5O12 | 24 | 12 | 214.6 |
mp-1377116 | 7.854604 | 9.140036 | 0.041948 | other | Nd2Ta2O9 | 13 | 12 | 188.73 |
mp-977244 | -4.839342 | -1.57289 | -3.07716 | other | Na1Ti5Se8 | 14 | 12 | 301.59 |
mp-559760 | 10.891006 | 8.141724 | 2.682984 | other | Sc4I4O4 | 12 | 12 | 279.25 |
mp-531021 | 8.145984 | 14.564094 | -1.051576 | other | Li11Mn13O32 | 56 | 12 | 568.6 |
mp-672231 | -1.533023 | 0.146025 | -1.993506 | other | La6Ge6Br4 | 16 | 12 | 441.76 |
mp-754971 | 9.10451 | 8.51452 | 0.165213 | other | Cs6Tm2O6 | 14 | 12 | 371.76 |
mp-1245832 | 1.532745 | 1.999053 | 1.096421 | other | Ca4Cu4N4 | 12 | 12 | 211.17 |
mp-1232175 | -3.095697 | -2.145972 | -5.754518 | other | Mg2Sc2S6 | 10 | 12 | 240.87 |
mp-1443117 | 1.575554 | 1.859007 | 1.219106 | other | Ca4Cu2N4 | 10 | 12 | 158.95 |
mp-1542758 | 12.191339 | 10.64837 | 0.426698 | original | Sr2Mo2O6 | 10 | 12 | 135.04 |
mp-1216817 | -5.353399 | -3.483452 | 4.772317 | other | U2Si2Au2 | 6 | 12 | 119.08 |
mp-771265 | 8.342588 | 14.197034 | -1.596784 | other | Ti2Mn18O40 | 60 | 12 | 698.38 |
mp-1180241 | 6.793326 | 6.51956 | -3.582111 | other | Na2Pt1O6 | 9 | 12 | 120.52 |
mp-997019 | 6.738791 | 8.91116 | -1.213628 | other | Ag2Pb2O4 | 8 | 12 | 149.28 |
mp-1226819 | -7.644092 | -4.909904 | 3.704767 | other | Ce2Ni2Sn2 | 6 | 12 | 127.47 |
mp-766393 | 11.610917 | 12.650686 | 1.724562 | other | Li7Ti11O24 | 42 | 12 | 451.61 |
mp-1273130 | 16.218584 | 9.760441 | 5.064821 | other | Mg6Fe2O8 | 16 | 12 | 151.08 |
mp-779013 | 8.750839 | 15.470686 | -1.467033 | other | Mn8O12F4 | 24 | 12 | 254.74 |
mp-865631 | 6.318815 | 13.489244 | -1.296468 | other | Li2Ni2O4 | 8 | 12 | 66.32 |
mp-561133 | 10.228776 | 10.719725 | 3.394923 | other | Sr5Nb4O15 | 24 | 12 | 333.3 |
mp-1220225 | -8.884783 | -5.89506 | 4.243921 | other | Nd2Cu2Ag2 | 6 | 12 | 125.85 |
mp-1105281 | 6.278562 | 5.473617 | -4.17601 | other | Cr2N4O8 | 14 | 12 | 268.66 |
mp-1208115 | 9.573931 | 11.533756 | -4.251388 | other | V4N2O10 | 16 | 12 | 248.91 |
mp-9902 | -5.281258 | -3.153496 | 5.612133 | other | Sc4Co2Si4 | 10 | 12 | 160.25 |
mp-29590 | 8.961267 | 1.702347 | 0.505026 | other | Sn4O2F10 | 16 | 12 | 228.96 |
mp-753670 | -1.067543 | 2.234398 | -2.621991 | other | Ca1Pb1I4 | 6 | 12 | 266.04 |
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