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-2229097 | 7.752628 | 10.082517 | -3.831136 | other | Mg1Cr4O12 | 17 | 1 | 295.62 |
mp-676144 | -5.346504 | 0.025465 | -5.453304 | other | Ti1Cr2S4 | 7 | 1 | 115.7 |
mp-626562 | 10.414952 | 3.776765 | -4.14042 | other | Ca2H32O20 | 54 | 1 | 454.21 |
mp-1395214 | 7.70683 | 5.125814 | -1.759716 | other | V4O7F5 | 16 | 1 | 209.68 |
mp-1361818 | 7.477334 | 5.039876 | -1.690552 | other | Co5Bi8O20 | 33 | 1 | 491.07 |
mp-626750 | 10.981997 | 4.035583 | -3.96256 | other | Sr2H8O6 | 16 | 1 | 168.88 |
mp-627418 | 11.541506 | 4.461226 | -4.069896 | other | Ge7H18O23 | 48 | 1 | 473.58 |
mp-1178459 | 7.573411 | 9.941411 | -3.838929 | other | Cr12Fe7O48 | 67 | 1 | 926.74 |
mp-635393 | -1.138686 | 0.023834 | -1.570528 | other | Ca2P1I1 | 4 | 1 | 123.59 |
mp-762572 | 12.714018 | -0.082343 | -0.052433 | other | Mn12O14F10 | 36 | 1 | 395.46 |
mp-676333 | 11.804804 | 8.300845 | -0.198945 | other | Ga11N1O15 | 27 | 1 | 290.46 |
mp-765543 | 8.34384 | 11.656482 | -0.822121 | other | Sr3Rh16O32 | 51 | 1 | 617.01 |
mp-1247860 | -4.031465 | -1.416044 | -5.315739 | other | Ag5Au3S4 | 12 | 1 | 325.49 |
mp-1360989 | 6.311289 | 10.122414 | -2.045327 | other | Al8Fe6O24 | 38 | 1 | 412.01 |
mp-721795 | 8.38445 | 1.339927 | 1.082404 | other | Nd1Pb7F17 | 25 | 1 | 426.88 |
mp-706241 | 10.956272 | 11.199796 | -2.528165 | other | Rb8W13O43 | 64 | 1 | 1,136.3 |
mp-627141 | 13.395652 | 7.51797 | -1.265221 | other | Si20H20O30 | 70 | 1 | 961.38 |
mp-676711 | 8.242928 | 2.523195 | -1.444454 | other | C4I4F20 | 28 | 1 | 514.37 |
mp-627123 | 13.397299 | 7.466657 | -1.222313 | other | Si20H20O30 | 70 | 1 | 942.02 |
mp-1182430 | 10.437909 | 3.734229 | -4.142893 | other | Ca2H32O20 | 54 | 1 | 457.73 |
mp-685217 | 11.657932 | 8.03803 | -0.487812 | other | Na8Ga42O67 | 117 | 1 | 1,460.17 |
mp-530644 | 7.525951 | 12.032786 | 2.014951 | other | Nd18Mn20O60 | 98 | 1 | 1,196.01 |
mp-675681 | 8.49957 | 1.322908 | 1.973007 | other | Ba8Er6F34 | 48 | 1 | 734.37 |
mp-761089 | 11.809851 | -0.521994 | 1.186787 | other | Mn12O5F19 | 36 | 1 | 452.84 |
mp-861962 | 8.342008 | 1.916193 | -0.505049 | other | Ba1Sb2F12 | 15 | 1 | 232.25 |
mp-1216289 | 9.883801 | 7.330929 | -5.909879 | other | Zn8P6O26 | 40 | 1 | 607.39 |
mp-1178894 | 10.554981 | 8.529113 | -4.921425 | other | V4H4O12 | 20 | 1 | 262.15 |
mp-675593 | -4.761674 | 0.151793 | -4.882654 | other | K3V5S10 | 18 | 1 | 384.63 |
mp-676260 | -5.76941 | -2.94701 | -2.743044 | other | Ag9Te4Br3 | 16 | 1 | 437.05 |
mp-779774 | 12.698436 | 0.492663 | 0.229869 | other | Fe10O11F9 | 30 | 1 | 344.57 |
mp-757507 | 9.676939 | 8.609476 | 0.440113 | other | Sm6Bi10O24 | 40 | 1 | 689.41 |
mp-686129 | 1.894829 | 2.231695 | 1.607131 | other | Li80Ti16N48 | 144 | 1 | 1,399.52 |
mp-2647151 | 5.813946 | 2.13781 | -2.667199 | other | H5C56O1 | 62 | 1 | 2,208.87 |
mp-762347 | 2.552598 | 2.553973 | 1.113207 | other | Sn16N16O8 | 40 | 1 | 535.04 |
mp-763965 | 12.467901 | 12.557878 | -3.94773 | other | V6O9F9 | 24 | 1 | 295.48 |
mp-764645 | 10.048364 | 0.367766 | 0.031573 | other | Li6Mn2F14 | 22 | 1 | 273.6 |
mp-675345 | -3.824034 | -1.685426 | -5.213671 | other | Bi20S24Cl12 | 56 | 1 | 1,428.72 |
mp-1101234 | 12.459171 | 12.557584 | -3.934266 | other | V6O9F9 | 24 | 1 | 291.58 |
mp-756387 | 13.322122 | 0.502669 | 1.441217 | other | Fe6O5F7 | 18 | 1 | 211.39 |
mp-849552 | 12.79588 | -1.136449 | 0.690072 | other | Mn12O10F14 | 36 | 1 | 424.34 |
mp-776313 | 1.302337 | 1.910427 | 2.738069 | other | Ti16N16O8 | 40 | 1 | 428.7 |
mp-715212 | -4.000534 | -1.56777 | -5.491013 | other | In10Bi6S24 | 40 | 1 | 957.14 |
mp-1302830 | 10.921902 | 2.826038 | 1.475494 | other | V4O1F11 | 16 | 1 | 196.01 |
mp-706524 | 9.653211 | 8.500805 | 2.790266 | other | Sr6La8O18 | 32 | 1 | 678.51 |
mp-1221448 | 6.404713 | 13.484 | -1.87618 | other | Na1Co2O4 | 7 | 1 | 85.02 |
mp-1233779 | 6.688909 | 6.110165 | -3.800777 | other | Sr2Ca1O12 | 15 | 1 | 239.95 |
mp-760205 | 10.480525 | 4.383238 | -6.591014 | other | Ba16S16O59 | 91 | 1 | 1,451.53 |
mp-780092 | 10.562195 | 2.260674 | -0.193728 | other | V6O5F19 | 30 | 1 | 437.24 |
mp-705680 | 11.371618 | 11.065306 | -3.758332 | other | La4Mo4O18 | 26 | 1 | 389.07 |
mp-1274319 | 12.777295 | 13.402704 | -0.950197 | other | Li4V6O12 | 22 | 1 | 227.96 |
mp-757773 | 11.894794 | 13.825539 | -1.267258 | other | Li10V10O24 | 44 | 1 | 445.76 |
mp-1178312 | 12.483164 | 0.964791 | 2.469674 | other | Fe10O5F15 | 30 | 1 | 361.63 |
mp-1046025 | 13.010581 | 10.820576 | -0.384823 | other | Mg1Mo4O8 | 13 | 1 | 186.01 |
mp-764002 | 9.958122 | 12.030807 | -4.681417 | other | V6O12F6 | 24 | 1 | 305.9 |
mp-625838 | 10.421094 | 6.286896 | -4.236523 | other | Fe16H16O32 | 64 | 1 | 694.85 |
mp-2236422 | 11.206743 | 12.589741 | -3.590163 | other | V5Co1O12 | 18 | 1 | 252.96 |
mp-760134 | 10.485475 | 10.304791 | -0.028396 | other | Nb4Sb12O32 | 48 | 1 | 664.71 |
mp-1390793 | 4.486244 | 3.173354 | -3.747072 | other | Sb1S4N3 | 8 | 1 | 213.01 |
mp-676280 | 10.843484 | 11.745649 | 3.213845 | other | Na8Ta8O24 | 40 | 1 | 583.55 |
mp-686208 | 2.273179 | 2.24832 | 1.482272 | other | Li80Si16N48 | 144 | 1 | 1,271.31 |
mp-760930 | 11.410861 | 2.96568 | 1.311073 | other | V6O3F15 | 24 | 1 | 295.35 |
mp-1042597 | 12.950117 | 10.818389 | -0.409327 | other | Zn2Mo4O8 | 14 | 1 | 184.13 |
mp-675301 | 6.035545 | 5.184163 | -4.310547 | other | Na2N4O4 | 10 | 1 | 182.6 |
mp-626293 | 10.498247 | 3.689359 | -4.128356 | other | Sr2H32O20 | 54 | 1 | 459.12 |
mp-1173258 | 7.526237 | 10.453147 | 0.951966 | other | Sr16Rh8O32 | 56 | 1 | 802.38 |
mp-998157 | -0.472843 | 1.207867 | -4.589411 | other | Rb1Sn1Br3 | 5 | 1 | 205.87 |
mp-1227291 | -3.448972 | -3.798664 | 0.611323 | other | Cd8Cu7P30 | 45 | 1 | 872.6 |
mp-1046548 | 12.910588 | 10.613235 | -0.027489 | other | Zn1W4O8 | 13 | 1 | 190.12 |
mp-2229279 | 10.770376 | 13.272624 | -3.623228 | other | Mg1V5O12 | 18 | 1 | 201.73 |
mp-1177252 | 10.03622 | 11.912202 | 0.517123 | other | Li32Ti8O32 | 72 | 1 | 823.28 |
mp-531689 | 10.035538 | 13.067855 | 0.118111 | other | Ti12Ni12O36 | 60 | 1 | 624.1 |
mp-698762 | 11.752711 | 12.235597 | 1.10079 | other | Ta12Mn24O54 | 90 | 1 | 1,128.35 |
mp-531942 | 7.469178 | 12.920047 | -1.049222 | other | Li9Ni23O32 | 64 | 1 | 574.89 |
mp-676723 | 10.259049 | 4.309473 | -7.36153 | other | Li4S2O8 | 14 | 1 | 165.07 |
mp-880027 | 7.710899 | 11.200576 | -1.850244 | other | Li4Mn12O24 | 40 | 1 | 440.27 |
mp-625583 | 10.279972 | 3.078565 | -3.971315 | other | H14Br2O6 | 22 | 1 | 232.99 |
mp-675882 | 10.193015 | 9.799376 | 3.38321 | other | Dy10Ti5O25 | 40 | 1 | 572.22 |
mp-1218127 | 10.764077 | 8.139885 | -1.270299 | other | Tl32Si8O37 | 77 | 1 | 1,656.3 |
mp-1332293 | -4.186997 | -1.76618 | -3.355841 | other | K24B54Se54 | 132 | 1 | 3,301.99 |
mp-1644001 | 7.044513 | 19.57465 | -0.184636 | other | Li14Mn10O24 | 48 | 1 | 441.81 |
mp-673839 | 12.621469 | 12.169532 | -0.244962 | other | Mg12V8O24 | 44 | 1 | 478.98 |
mp-1248872 | 13.556565 | 7.367479 | -1.169544 | other | Si20H20O30 | 70 | 1 | 879.44 |
mp-762390 | 12.440871 | 13.39662 | -1.787154 | other | Li1V5O10 | 16 | 1 | 189.39 |
mp-1568829 | 10.58678 | 2.152161 | 2.395123 | other | Fe8O2F12 | 22 | 1 | 265.46 |
mp-1349934 | -2.62693 | -2.710116 | -5.672459 | other | Ho14Pb3S24 | 41 | 1 | 888.99 |
mp-675792 | -6.071309 | -3.493511 | -2.169014 | other | Ga8Hg4Te16 | 28 | 1 | 942.94 |
mp-1096805 | 5.92548 | 5.762645 | -3.910475 | other | Ag1Br1O2 | 4 | 1 | 118.07 |
mp-2217657 | 9.522918 | 14.332383 | -0.22885 | other | Mg1Mn4O6 | 11 | 1 | 127.6 |
mp-771044 | 9.240157 | 12.82368 | -1.645989 | other | Mn5Te3O16 | 24 | 1 | 309.47 |
mp-2217240 | 7.998056 | 10.361076 | -3.740928 | other | Mg1Cr2O6 | 9 | 1 | 152.49 |
mp-1182707 | 10.65653 | 5.822183 | -4.277002 | other | Fe16H20O34 | 70 | 1 | 682.89 |
mp-674325 | 7.018229 | 5.405733 | -4.82363 | other | Rb4C1O6 | 11 | 1 | 288.53 |
mp-2228945 | 11.403878 | 10.895117 | -3.334358 | other | Mg1Mo4O12 | 17 | 1 | 271.96 |
mp-1178341 | 12.701748 | 0.489613 | 0.230002 | other | Fe10O11F9 | 30 | 1 | 344.1 |
mp-685283 | -1.023545 | 2.449576 | -3.118595 | other | Ag13Bi15I64 | 92 | 1 | 4,233.17 |
mp-780760 | 13.370977 | 0.428942 | 1.212927 | other | Fe10O9F11 | 30 | 1 | 351.84 |
mp-1221046 | 8.83265 | 1.827874 | 1.909414 | other | Na3Pu3F12 | 18 | 1 | 238.18 |
mp-756120 | 11.800235 | 0.794563 | -0.140338 | other | Fe6O7F5 | 18 | 1 | 208.07 |
mp-1180517 | 6.719896 | 6.146433 | -4.024812 | other | Mg1S1O9 | 11 | 1 | 244.56 |
mp-1200595 | 10.914037 | 12.019702 | -3.48797 | other | V8Cd18O38 | 64 | 1 | 919.63 |
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