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-1196128 | 8.439754 | 2.814053 | -2.680871 | other | Li1Al1H8C16O8F36 | 70 | 82 | 854.92 |
mp-2232061 | 8.765625 | 3.708229 | -6.934934 | other | Ba4Na1Mg1Cu1C2O10 | 19 | 82 | 331.13 |
mp-740871 | 5.353251 | 3.362536 | -4.119479 | other | Ba4Zn4C16S16N16O28 | 84 | 82 | 1,706.02 |
mp-1196193 | 8.076159 | 0.827265 | -4.369081 | other | Fe1Sn4H24C8Se10N2 | 49 | 82 | 892.93 |
mp-2218118 | 8.442675 | 1.312119 | -4.282078 | other | Mg1Ag1Mo1H4S4N1 | 12 | 82 | 195.92 |
mp-1199595 | 8.078341 | 0.818476 | -4.362143 | other | Mn1Sn4H24C8Se10N2 | 49 | 82 | 867.2 |
mp-698410 | 8.3007 | 0.794234 | -4.41082 | other | Mn1Ge4H24C8S10N2 | 49 | 82 | 684.25 |
mp-1196087 | 9.011073 | 2.661045 | -4.718853 | other | Li1H12Au1C4S4O12 | 34 | 82 | 456.57 |
mp-1204843 | 8.023099 | 3.762252 | -3.730034 | other | Rb4C8S8N4O20F24 | 68 | 82 | 1,083.85 |
mp-736330 | 8.256785 | 0.79134 | -4.422108 | other | Fe1Ge4H24C8S10N2 | 49 | 82 | 671.3 |
mp-1199306 | 8.075638 | 1.723623 | -4.436409 | other | Co4H64C16S16N32Cl8 | 140 | 86 | 1,744.98 |
mp-723036 | 8.090589 | 1.726081 | -4.437102 | other | Fe4H64C16S16N32Cl8 | 140 | 86 | 1,743.47 |
mp-1199490 | 8.08707 | 1.70227 | -4.419829 | other | Mn4H64C16S16N32Cl8 | 140 | 86 | 1,865.91 |
mp-699261 | 8.089121 | 1.715795 | -4.430505 | other | Cd4H64C16S16N32Cl8 | 140 | 86 | 1,882.46 |
mp-709352 | 10.402844 | 3.154609 | -4.805564 | other | Na8Sc8P16H48C16O52 | 148 | 86 | 1,779.38 |
mp-731948 | 4.370206 | 2.730802 | -3.493379 | other | K8Re8C24S8N24O8 | 80 | 88 | 1,483.21 |
mp-1198947 | 5.174697 | 3.195194 | -4.086233 | other | Fe4Hg8C24S8N8O16 | 68 | 88 | 1,562.53 |
mp-559978 | 8.121622 | 2.710905 | -2.151825 | other | Cu2As4S16N16O8F56 | 102 | 88 | 1,514.97 |
mp-1201527 | 8.324018 | 6.200614 | -5.601835 | other | Cu4Si4Pb4C4Cl1O28 | 45 | 87 | 616.92 |
mp-17718 | 12.416977 | 7.313899 | -0.766474 | other | Cs1K1Na2Li12Si4O16 | 36 | 87 | 399.09 |
mp-42599 | 10.312591 | 11.511746 | 3.19358 | other | Na4Y4Ti4Nb4O24F4 | 44 | 91 | 557.9 |
mp-684861 | 7.90925 | 9.360637 | -0.745777 | other | Na4Yb4Ti4Nb4O24F4 | 44 | 91 | 558.22 |
mp-43055 | 10.812621 | 11.106625 | 3.045609 | other | Na4Ce4Ti4Nb4O24F4 | 44 | 91 | 570.96 |
mp-42897 | 10.336496 | 11.42945 | 3.24266 | other | Na4Pr4Ti4Nb4O24F4 | 44 | 91 | 573.93 |
mp-43134 | 10.309815 | 11.460238 | 3.224941 | other | Na4Nd4Ti4Nb4O24F4 | 44 | 91 | 570.3 |
mp-738635 | 9.976586 | 7.496838 | -6.151749 | other | Na8Zn8P16H8Cl8O56 | 104 | 92 | 1,453.98 |
mp-720721 | 8.869364 | 2.180559 | -4.45066 | other | Si4H72C16N32O16F24 | 164 | 92 | 1,570.45 |
mp-1195389 | 8.315088 | 1.430146 | -4.496441 | other | P8H64Pb4C24N8O24 | 132 | 92 | 1,608.53 |
mp-1199720 | 8.299095 | 0.856326 | -4.50522 | other | Ge4Sb8H64C16S24N8 | 124 | 92 | 1,743.98 |
mp-42981 | 10.28119 | 11.480707 | 3.151355 | other | Na4Gd4Ti4Nb4O24F4 | 44 | 95 | 563.22 |
mp-43048 | 9.105975 | 10.994491 | 1.956733 | other | Na4Eu4Ti4Nb4O24F4 | 44 | 95 | 567.94 |
mp-1199530 | 8.131081 | 1.611424 | -4.475833 | other | Cu8H96C24S24I8N48 | 208 | 96 | 2,999.48 |
mp-1197738 | 8.116444 | 1.674711 | -4.452109 | other | Cu8H96C24S24Br8N48 | 208 | 96 | 2,780.75 |
mp-1199396 | 8.115987 | 1.686621 | -4.445886 | other | Cu8H96C24S24N48Cl8 | 208 | 96 | 2,678.76 |
mp-1228046 | 8.385425 | 10.675435 | 0.857372 | other | Ba1Fe1Cu1Pb2Cl1O5 | 11 | 99 | 182.99 |
mp-2232641 | 11.478745 | 10.260681 | 1.160446 | other | Sr4Mg1V2Fe2As2O6 | 17 | 99 | 291.21 |
mp-1227981 | 8.16011 | 9.00338 | 1.588904 | other | Ba1Sr3Co2Cu4S4O4 | 18 | 99 | 294.5 |
mp-2222848 | 10.177345 | 10.222734 | 1.485183 | other | Ba1Y1Mg1Co1Cu1O5 | 10 | 99 | 142.33 |
mp-2230626 | 11.018808 | 10.118833 | 2.773864 | other | K2Na2Eu2Mg1Nb2O10 | 19 | 99 | 304.91 |
mp-2217420 | 11.12281 | 10.078878 | 1.490203 | other | Ba1Y1Mg1Cr1Cu1O5 | 10 | 99 | 155.76 |
mp-2231300 | 11.584135 | 9.765926 | 2.422425 | other | K2Na2La2Mg1Nb2O10 | 19 | 99 | 307.28 |
mp-2230401 | 11.649323 | 9.695877 | 2.378124 | other | K2Na2Nd2Mg1Nb2O10 | 19 | 99 | 303.57 |
mp-2240198 | 9.244613 | 10.291344 | 1.590237 | other | Ba1Y1Mg1Co1Cu1O5 | 10 | 99 | 165.79 |
mp-1228289 | 8.328845 | 10.770511 | 2.338616 | other | Ba4Nd4Ti3Mn1Cu4O22 | 38 | 99 | 493.44 |
mp-2242083 | 8.733216 | 9.428551 | 1.896369 | other | Ba1Y1Mg1Cu1Bi1O5 | 10 | 99 | 180.79 |
mp-2239848 | 12.106112 | 9.802223 | 1.659008 | other | Ba1Y1Mg1Ti1Cu1O5 | 10 | 99 | 146.77 |
mp-2227680 | 12.009278 | 10.45053 | 2.453638 | other | La1Mg1Nb2Cu1Cl1O7 | 13 | 99 | 195.18 |
mp-1236302 | 10.729128 | 9.434967 | -0.795705 | other | Li1Bi3Pb1W1Cl1O8 | 15 | 99 | 237.71 |
mp-2230291 | 11.638883 | 9.670253 | 2.385013 | other | K2Na2Pr2Mg1Nb2O10 | 19 | 99 | 306.25 |
mp-1228462 | 8.193936 | 8.769245 | 1.503648 | other | Ba3Sr1Co2Cu4S4O4 | 18 | 99 | 308.14 |
mp-2222863 | 8.335514 | 9.763358 | 1.673305 | other | Ba1Y1Mg1Cu1Ag1O5 | 10 | 99 | 146.94 |
mp-1218787 | 7.481195 | 10.576953 | 1.313865 | other | Sr4Ce1Y3Cu4Ru2O20 | 34 | 99 | 429.85 |
mp-2228464 | 8.685248 | 9.641411 | 1.442114 | other | Sr2Y1Mg1Tl1Cu2O7 | 14 | 99 | 230.24 |
mp-2230196 | 11.18716 | 10.082881 | 2.340269 | other | Ba2Tb2Mg1Ti2Cu2O11 | 20 | 99 | 274.21 |
mp-1218475 | 10.322302 | 9.633227 | 2.574676 | other | Sr4Mg1Ti1Fe2As2O6 | 16 | 99 | 271.47 |
mp-2231484 | 11.694695 | 9.75741 | 2.371818 | other | K2Na2Sm2Mg1Nb2O10 | 19 | 99 | 299.48 |
mp-2222919 | 10.781355 | 10.226508 | 1.337233 | other | Ba1Y1Mg1Fe1Cu1O5 | 10 | 99 | 145.95 |
mp-1236216 | 10.586933 | 9.624902 | -0.900411 | other | Li1Bi3Pb1W1Cl1O8 | 15 | 99 | 237.73 |
mp-1228757 | 7.960644 | 10.665045 | 2.010139 | other | Ba2Ca1Eu2Ti3Cu2O14 | 24 | 99 | 304.92 |
mp-721094 | 10.295971 | 11.133322 | 3.14807 | other | Na5Ca2Ce3Ti8Nb2O30 | 50 | 99 | 608.85 |
mp-1219593 | 10.7082 | 11.019329 | 3.101978 | other | Rb1Nd1Ti1Nb1O6F1 | 11 | 99 | 168.49 |
mp-2241433 | 8.102403 | 10.469987 | 1.767534 | other | Sr4Mg1Mn2Cu2S2O6 | 17 | 99 | 294.23 |
mp-2223891 | 10.722711 | 10.13447 | 1.560177 | other | Ba1Y1Mg1Mn1Cu1O5 | 10 | 99 | 150.49 |
mp-1218622 | 8.358814 | 10.429767 | 2.340925 | other | Sr4Ce1Sm3Nb2Cu4O20 | 34 | 99 | 451.19 |
mp-1228548 | 9.33766 | 10.66233 | 2.954583 | other | Ba2Ca1Tb2Ti3Cu2O14 | 24 | 99 | 303.19 |
mp-1218736 | 8.01045 | 10.646338 | 1.918105 | other | Sr6Ce2Y4Fe3Cu3O24 | 42 | 99 | 570.34 |
mp-2218929 | 12.110013 | 10.284759 | 2.322406 | other | La1Mg1Ta2Cu1Cl1O7 | 13 | 99 | 192.24 |
mp-1235925 | 10.625357 | 9.353061 | -0.709066 | other | Li1Bi3Pb1W1Cl1O8 | 15 | 99 | 237.22 |
mp-1223617 | 13.339952 | 6.751214 | -0.798986 | other | K4Mg8Al4Fe4Si12H8O48 | 88 | 1 | 1,055.55 |
mp-1220956 | 13.346863 | 5.798209 | -2.381863 | other | Na8Zr3Ti3Mn2Si8O34F2 | 60 | 1 | 727.11 |
mp-1202345 | 13.488411 | 4.659624 | -7.079558 | other | Na12Li4Y6Zr6P12C4O68 | 112 | 1 | 1,367.48 |
mp-1198245 | 7.893557 | 0.295479 | -4.497183 | other | Ga1Si6Bi1H54C18N4Cl4 | 88 | 1 | 1,124.27 |
mp-1223435 | 12.792209 | 6.514076 | -0.585168 | other | K1Na1Ca1Mg5Si8O22F2 | 40 | 1 | 472.46 |
mp-1227900 | 12.61337 | 6.563897 | -0.441122 | other | Ba1Li1Mg2Al1Si3O10F2 | 20 | 1 | 248.1 |
mp-1221508 | 14.234155 | 4.318334 | -6.939225 | other | Na11Ti1Nb2Si4P2O25F1 | 46 | 1 | 564.69 |
mp-1200090 | 9.167583 | 7.380639 | -4.740286 | other | Na7Ti1Nb2Si4P2O29F1 | 46 | 1 | 591.24 |
mp-1195233 | 9.474841 | 1.73041 | -4.35776 | other | Al2Zn2B10H40C10N10O20 | 94 | 1 | 877.33 |
mp-561052 | 13.271483 | 5.603831 | -3.929734 | other | Ba4Na2Ca1Ti3Si4S2O26 | 42 | 1 | 585.52 |
mp-1229246 | 8.119768 | 0.610293 | -4.396763 | other | B2P6H60Ir2C18O3F8 | 99 | 1 | 1,071.33 |
mp-1225303 | 11.410894 | 5.41521 | -5.585386 | other | K1Fe8P8H16N7O32F8 | 80 | 1 | 919.33 |
mp-1223878 | 12.583179 | 5.689251 | -6.342313 | other | K2Al1Fe1B2P4H2O18 | 30 | 1 | 348.11 |
mp-1223630 | 12.632136 | 6.497956 | -1.058576 | other | K1Ba1Na2Ti3Fe1Si4O18 | 30 | 1 | 394.01 |
mp-1221134 | 12.727342 | 6.568452 | -0.467495 | other | Na1Ca2Mg5Al1Si7O22F2 | 40 | 1 | 468.28 |
mp-1223590 | 12.648073 | 7.666157 | -0.783442 | other | K1Mg1Mn2Al1Ge3O10F2 | 20 | 1 | 281.95 |
mp-1235507 | 8.361485 | 9.274912 | 1.405021 | other | Ba1Sr1Li1Nd1Tl1Cu2O7 | 14 | 1 | 210.11 |
mp-1235732 | 8.221906 | 9.391431 | 1.456838 | other | Ba1Sr1Li1Nd1Tl1Cu2O7 | 14 | 1 | 207.1 |
mp-1195311 | 12.590776 | 6.596374 | -0.425635 | other | Ca2La2Mg2Al4Si6H2O26 | 44 | 11 | 478.33 |
mp-1210199 | 12.861346 | 5.272918 | -6.051829 | other | Na2Ca2Al2P2H2O10F4 | 24 | 11 | 269.27 |
mp-1198212 | 8.12901 | 3.360257 | -3.412672 | other | Cs2Mo4H4C14S14O42F42 | 122 | 11 | 2,119.43 |
mp-707176 | 12.406867 | 5.012472 | -5.363946 | other | Na2Ca4Al4P4H10O22F8 | 54 | 11 | 550.98 |
mp-1202925 | 8.228981 | 1.841876 | -4.402506 | other | Sb4H10C6S2Cl12O10F6 | 50 | 11 | 992.34 |
mp-707491 | 9.271347 | 4.286568 | -4.352001 | other | Re12H24Pb6C4S4N8O52 | 110 | 113 | 1,608.52 |
mp-1218684 | 7.229074 | 10.305173 | 1.244887 | other | Sr4Ca1Y1Fe1Cu4Pb1O14 | 26 | 119 | 350.83 |
mp-1199737 | 12.898635 | 5.967257 | -0.804912 | other | K12Al8Si12B2H8Cl2O48 | 92 | 114 | 1,319.4 |
mp-1200379 | 10.172942 | 7.178817 | -2.299525 | other | K4Ba2Na4Ti8Mn1Si16O66 | 101 | 12 | 1,379.19 |
mp-1182654 | 11.494461 | 5.528089 | -5.686438 | other | Ca2Mn2Al8Si2P6H10O40 | 70 | 12 | 871.56 |
mp-1199709 | 13.102074 | 5.363214 | -5.741716 | other | Ca2Mn2Al8Si2P6H10O40 | 70 | 12 | 681.49 |
mp-1202327 | 7.157153 | 7.984247 | -3.363033 | other | Al1Cu4Sb1Pb6S2Cl4O26 | 44 | 12 | 647.06 |
mp-1200316 | 7.28883 | 0.292724 | -3.905468 | other | Sn4Hg1B44H124C24N8Cl2 | 207 | 121 | 2,683.61 |
mp-698491 | 9.451699 | 3.457191 | -6.268275 | other | Na2Ca4Al8H16C8Cl2O40 | 80 | 129 | 849.41 |
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