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-1217251 | -5.156063 | -2.591407 | 2.614334 | other | Ti20Sb9Se3 | 32 | 6 | 589.91 |
mp-759659 | 13.27808 | 0.399527 | 0.908332 | other | Fe12O12F12 | 36 | 6 | 420.05 |
mp-1173083 | 10.55693 | 10.694112 | 2.028485 | other | Nb6Pb10O25 | 41 | 6 | 658.33 |
mp-2218959 | 12.71295 | 13.123767 | -1.060498 | other | Mg1V4O8 | 13 | 6 | 146.34 |
mp-2219024 | 8.506151 | 14.798532 | -1.060347 | other | Mg1Mn4O8 | 13 | 6 | 144.26 |
mp-1227621 | 9.540185 | 8.607601 | -0.102047 | other | Ca4Bi6O13 | 23 | 6 | 387.7 |
mp-780169 | 1.679048 | 1.803222 | 2.943556 | other | Hf12N12O6 | 30 | 6 | 361.06 |
mp-1221593 | 10.66282 | 8.992673 | -5.194727 | other | Mo2P2O11 | 15 | 6 | 218.74 |
mp-1247890 | 12.628761 | 6.852345 | -0.153938 | other | Al16Si8O40 | 64 | 6 | 712.49 |
mp-752804 | 13.281929 | 0.424011 | 0.911064 | other | Fe8O8F8 | 24 | 6 | 280.4 |
mp-675830 | -4.849612 | -1.438319 | -5.786089 | other | Fe1Cu5S4 | 10 | 6 | 160.9 |
mp-1247659 | 7.299311 | 12.256124 | 1.526063 | other | Ca8Mn8O21 | 37 | 6 | 458.33 |
mp-1226302 | -6.214661 | -1.629301 | 1.482629 | other | Cr3Fe1As4 | 8 | 6 | 117.44 |
mp-764747 | 13.284607 | 0.379544 | 0.898576 | other | Fe12O12F12 | 36 | 6 | 415.87 |
mp-1101129 | -1.045764 | 2.33231 | -3.026675 | other | Th1Pb1I12 | 14 | 6 | 707.04 |
mp-998308 | -0.204502 | 0.848962 | -4.195863 | other | Cs1Sc1Br3 | 5 | 6 | 168.39 |
mp-758442 | 13.12481 | 0.402043 | 0.930969 | other | Fe6O6F6 | 18 | 6 | 222.36 |
mp-764080 | 10.195711 | 1.612932 | -2.060852 | other | Co8O8F8 | 24 | 6 | 251.47 |
mp-1215629 | -0.027736 | 1.235469 | -4.460492 | other | Zn3P1Br3 | 7 | 6 | 183.25 |
mp-764940 | 13.186683 | 0.378307 | 0.92812 | other | Fe12O12F12 | 36 | 6 | 432.37 |
mp-778064 | 11.7243 | 7.927761 | 0.011813 | other | Ga12N4O12 | 28 | 6 | 373.92 |
mp-1190870 | 8.935998 | 5.586518 | -6.462248 | other | Ce2S4O17 | 23 | 6 | 337.12 |
mp-758664 | 13.282034 | 0.39878 | 0.893407 | other | Fe18O18F18 | 54 | 6 | 624.61 |
mp-1222085 | -6.122395 | -1.733325 | 1.319926 | other | Mn8Cr4As12 | 24 | 6 | 349.7 |
mp-1225150 | -7.746489 | 1.05964 | 5.011649 | other | Ho8Fe68C3 | 79 | 6 | 1,037.97 |
mp-754911 | 12.865716 | -0.907626 | 0.482547 | other | Mn6O6F6 | 18 | 6 | 210.09 |
mp-758782 | 13.270967 | 0.388105 | 0.913985 | other | Fe12O12F12 | 36 | 6 | 420.07 |
mp-1217186 | -3.803033 | -0.906661 | -5.424562 | other | Ti3Sn5S12 | 20 | 6 | 458.63 |
mp-1228454 | -4.844872 | -3.079268 | -4.136881 | other | Al2Zn1Se4 | 7 | 6 | 176.22 |
mp-1371352 | 8.293948 | 13.330826 | -1.091846 | other | Zn4Fe8O16 | 28 | 6 | 275.23 |
mp-759130 | 13.274442 | 0.386699 | 0.91329 | other | Fe18O18F18 | 54 | 6 | 629.49 |
mp-759283 | 13.252109 | 0.394374 | 0.898191 | other | Fe4O4F4 | 12 | 6 | 140 |
mp-758716 | 13.270922 | 0.386557 | 0.906295 | other | Fe12O12F12 | 36 | 6 | 418.53 |
mp-1224389 | -4.336088 | -3.07221 | -3.777684 | other | Ge3Pb1Se4 | 8 | 6 | 210.87 |
mp-694888 | 7.357214 | 11.75122 | 1.894743 | other | Ba8Mn8O21 | 37 | 6 | 533.24 |
mp-1178318 | 10.038273 | 2.900264 | 1.902271 | other | Fe12O8F8 | 28 | 6 | 354.45 |
mp-1228028 | -5.98369 | -7.175246 | 3.108786 | other | Ba3Sr1Ag4 | 8 | 6 | 281.75 |
mp-1221749 | -5.930181 | -0.929567 | 1.822752 | other | Mn3Fe1P4 | 8 | 6 | 97.25 |
mp-1219027 | -8.195553 | -5.262028 | 5.962773 | other | Sm1Ho3Ni4 | 8 | 6 | 159.78 |
mp-1220606 | -4.640789 | -1.236881 | -3.125229 | other | Nb5Cr3Se20 | 28 | 6 | 640.86 |
mp-782663 | 10.497709 | 0.650596 | -0.730173 | other | Co6O2F10 | 18 | 6 | 208.81 |
mp-1178244 | 13.270427 | 0.378179 | 0.895122 | other | Fe18O18F18 | 54 | 6 | 625.68 |
mp-881183 | 13.197221 | 0.518441 | 0.706293 | other | Fe4O4F4 | 12 | 6 | 132.95 |
mp-1101619 | 8.438999 | 1.592586 | 2.319718 | other | Nd6O4F10 | 20 | 6 | 328.7 |
mp-1218111 | -5.745374 | -2.145619 | -1.386582 | other | Ta4Fe5Te12 | 21 | 6 | 529.75 |
mp-759201 | 13.18291 | 0.382602 | 0.742262 | other | Fe12O12F12 | 36 | 6 | 404.18 |
mp-753842 | 10.945388 | 9.683682 | 3.757661 | other | Y1Zr5O11 | 17 | 6 | 213.38 |
mp-759475 | 13.259986 | 0.404862 | 0.911387 | other | Fe12O12F12 | 36 | 6 | 423.22 |
mp-1216739 | -5.471622 | -1.062185 | 2.307301 | other | Ti1P4W3 | 8 | 6 | 118.85 |
mp-779315 | 14.769402 | 12.33405 | -0.851853 | other | V8O8F8 | 24 | 6 | 279.03 |
mp-985595 | 10.943139 | 8.872677 | 0.172459 | other | Zn24H4O24 | 52 | 6 | 1,598.59 |
mp-755761 | 13.349555 | 0.456861 | 1.429749 | other | Fe6O5F7 | 18 | 6 | 211.35 |
mp-753238 | 13.26602 | 0.38096 | 0.899974 | other | Fe8O8F8 | 24 | 6 | 279.35 |
mp-29928 | 1.950554 | 2.021477 | 1.052666 | other | Na3Li3N2 | 8 | 6 | 121.18 |
mp-995285 | -7.063117 | 0.659109 | 3.507176 | other | V1Fe11C4 | 16 | 6 | 155.88 |
mp-2235089 | 10.999283 | 12.6779 | -3.677494 | other | V4Zn1O10 | 15 | 6 | 212.99 |
mp-1234451 | 12.518054 | 13.619743 | -1.644216 | other | Mg1V8O16 | 25 | 6 | 318.37 |
mp-1219443 | 9.166988 | 10.739301 | 2.151479 | other | Sc2Cu2O5 | 9 | 6 | 109.79 |
mp-765486 | 12.604112 | 7.543275 | 0.667577 | other | Pr1Al22O34 | 57 | 6 | 631.72 |
mp-779316 | 14.770881 | 12.336061 | -0.852186 | other | V8O8F8 | 24 | 6 | 278.7 |
mp-758902 | 13.286001 | 0.393343 | 0.892636 | other | Fe12O12F12 | 36 | 6 | 415.99 |
mp-675231 | 10.240334 | 9.809289 | 3.837308 | other | Y4Zr18O44 | 66 | 6 | 778.27 |
mp-752992 | 13.286919 | 0.384639 | 0.912452 | other | Fe8O8F8 | 24 | 6 | 277.97 |
mp-1235275 | 12.837228 | 10.457668 | 1.934091 | other | Li1Ti4O6 | 11 | 6 | 114.66 |
mp-1225418 | -7.658275 | -1.621732 | 2.667029 | other | Ga4Si8Ni24 | 36 | 6 | 391.88 |
mp-1100858 | -3.151012 | -1.964325 | -5.329004 | other | Yb8Pb2S16 | 26 | 6 | 606.28 |
mp-626489 | 12.619803 | 12.901009 | -1.746517 | other | V4H2O8 | 14 | 6 | 133.27 |
mp-849300 | 13.362758 | 0.435846 | 1.204102 | other | Fe10O9F11 | 30 | 6 | 351.99 |
mp-763908 | 13.083157 | 13.186776 | -1.771714 | other | V6O10F2 | 18 | 6 | 182.11 |
mp-1569012 | 10.659438 | 2.107406 | 2.41972 | other | Fe8O2F12 | 22 | 6 | 261.81 |
mp-676611 | -3.865124 | -1.68692 | -5.230683 | other | Bi7S9Cl3 | 19 | 6 | 593.78 |
mp-1206089 | -5.682273 | -3.083167 | 5.771633 | other | Tb2Si3Ir3 | 8 | 6 | 136.52 |
mp-754612 | 12.759027 | -0.127039 | 0.022136 | other | Mn6O7F5 | 18 | 6 | 205.6 |
mp-1222756 | -6.874683 | -4.687699 | 5.423235 | other | Li1Tm2Ge4 | 7 | 6 | 135.75 |
mp-1217202 | -6.201505 | -1.081786 | 4.024211 | other | Ti3Cr9Si4 | 16 | 6 | 197.29 |
mp-752454 | 14.772932 | 12.337965 | -0.844139 | original | V6O6F6 | 18 | 6 | 209.77 |
mp-754879 | 13.262678 | 0.376874 | 0.907533 | other | Fe6O6F6 | 18 | 6 | 210.24 |
mp-1235320 | 12.171838 | 13.729019 | -1.953318 | other | Li1V8O16 | 25 | 6 | 324.2 |
mp-1217207 | 3.070913 | -0.154432 | -1.649068 | other | Ti2Fe2H3 | 7 | 6 | 59.06 |
mp-1286827 | 12.720096 | 13.275275 | -0.955049 | other | Na4V8O16 | 28 | 6 | 354.85 |
mp-1216147 | -5.568686 | -5.454834 | 0.857358 | other | Yb18Zn9Sb18 | 45 | 6 | 1,247.32 |
mp-1178228 | 13.279664 | 0.383578 | 0.907056 | other | Fe12O12F12 | 36 | 6 | 417.46 |
mp-1220695 | -5.54946 | -2.232594 | -1.566047 | other | Nb2Cu1Te4 | 7 | 6 | 174.82 |
mp-1227793 | -3.240421 | -1.813429 | -5.668108 | other | Ba1Sn3S4 | 8 | 6 | 219.74 |
mp-998174 | -0.666799 | 1.332321 | -4.625665 | other | Rb1Pd1Br3 | 5 | 6 | 148.25 |
mp-2232191 | 12.28536 | 11.070871 | 2.19886 | other | Mg1Nb4O10 | 15 | 6 | 201.48 |
mp-2223715 | 10.342106 | 12.426057 | -3.996695 | other | Mg1V8O20 | 29 | 6 | 400.04 |
mp-2235111 | 10.324383 | 12.43954 | -4.025595 | other | Mg1V8O20 | 29 | 6 | 417.72 |
mp-2227941 | -4.516062 | -1.165368 | -5.601326 | other | Mg1Cu2S4 | 7 | 6 | 121.72 |
mp-1041295 | 12.612992 | 10.807852 | -0.557291 | other | Ho2W4O12 | 18 | 6 | 240.68 |
mp-998781 | 6.508002 | 11.741163 | -1.414527 | other | Tl1Ni1O3 | 5 | 6 | 57.67 |
mp-1224567 | -4.03532 | -1.357951 | -5.80025 | other | In10Sn1S14 | 25 | 6 | 610.37 |
mp-1098049 | -6.103279 | -11.317558 | 5.834366 | other | Cs1K1Mg6 | 8 | 6 | 284.5 |
mp-1101139 | -5.862988 | -3.609365 | -1.384663 | other | Th2Cu1Te6 | 9 | 6 | 288.16 |
mp-759467 | 13.164521 | 0.375052 | 0.934929 | other | Fe12O12F12 | 36 | 6 | 436.12 |
mp-759503 | 13.275647 | 0.402904 | 0.91177 | other | Fe12O12F12 | 36 | 6 | 420.74 |
mp-2217142 | 12.136003 | 11.108789 | -2.45348 | other | Mg1Mo2O6 | 9 | 6 | 119.9 |
mp-2241454 | 10.964034 | 12.533958 | -3.576226 | other | Mg1V4O10 | 15 | 6 | 211.73 |
mp-764890 | 13.280977 | 0.399921 | 0.88488 | other | Fe12O12F12 | 36 | 6 | 415.81 |
mp-759425 | 13.266377 | 0.38381 | 0.867251 | other | Fe12O12F12 | 36 | 6 | 415.01 |
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