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-1208049 | -8.336859 | -6.445899 | 6.724196 | other | Tm16Mg4Rh4 | 24 | 216 | 614.09 |
mp-962074 | -7.314447 | -7.249076 | 4.898235 | other | Y1Tl1Cd1 | 3 | 216 | 93.42 |
mp-1211561 | -7.169926 | -6.422469 | 6.350035 | other | La16Mg4Ni4 | 24 | 216 | 728 |
mp-3201 | -7.732069 | -5.83423 | 3.258934 | other | Li2Ga1Pd1 | 4 | 216 | 54.84 |
mp-567418 | -6.253556 | -4.477965 | 0.907333 | other | Ho1Sb1Pd1 | 3 | 216 | 76.23 |
mp-1222875 | -7.084357 | -4.594518 | 6.377169 | other | La1Er1Al4 | 6 | 216 | 127.69 |
mp-1018016 | -6.091742 | -2.858774 | 4.1254 | other | Ti2Al1Ni1 | 4 | 216 | 59.08 |
mp-631542 | -5.064084 | -7.072996 | 3.824393 | other | Ba1Zr1Ni1 | 3 | 216 | 83.33 |
mp-35530 | 8.353113 | 14.483688 | -1.355448 | other | Li4Mn16O32 | 52 | 216 | 522.1 |
mp-631500 | -6.434713 | -9.941155 | 5.957628 | other | Ba1Hf1Mg2 | 4 | 216 | 116.25 |
mp-568156 | -8.195258 | -6.605384 | 6.800088 | other | Y16Cd4Ru4 | 24 | 216 | 632.13 |
mp-33300 | 9.118409 | 13.333863 | -1.045506 | other | Fe5Cu1O8 | 14 | 216 | 155.82 |
mp-1225043 | -7.694943 | -0.039263 | 5.827866 | other | Dy1Y1Fe4 | 6 | 216 | 98.31 |
mp-12558 | -5.031949 | -5.007637 | 0.313127 | other | Li1Mg1As1 | 3 | 216 | 58.33 |
mp-631560 | -5.68571 | -1.436522 | 3.983753 | other | Sr1Mn1Re2 | 4 | 216 | 67.03 |
mp-1222655 | -3.931287 | -5.539248 | 5.43781 | other | Li2In1Si1 | 4 | 216 | 73.56 |
mp-2219114 | 12.487272 | 11.727602 | 1.914137 | other | Mg1Ti4O8 | 13 | 216 | 153.55 |
mp-569333 | -6.068842 | -6.011413 | 0.523118 | other | Li2Ag1Bi1 | 4 | 216 | 78.13 |
mp-1222662 | -5.823293 | -6.086076 | 0.577922 | other | Li2Mg1Bi1 | 4 | 216 | 90.28 |
mp-1227052 | 8.959102 | 2.427431 | 2.012262 | other | Ca1H1F1 | 3 | 216 | 41.15 |
mp-631387 | -7.059671 | -1.989541 | 3.841487 | other | Sn1Ru1W1 | 3 | 216 | 59.78 |
mp-631354 | -7.434971 | -1.400477 | 4.445095 | other | Re1Os1Ru1 | 3 | 216 | 51.9 |
mp-1077741 | -9.436729 | -4.808049 | 3.776474 | original | Yb1Cu4Ag1 | 6 | 216 | 89.26 |
mp-11390 | -3.614163 | -5.145706 | 6.245866 | other | Li1Ga1Si1 | 3 | 216 | 51 |
mp-4025 | -6.284279 | -3.69535 | 0.967166 | other | Tm1Ni1Sb1 | 3 | 216 | 61.02 |
mp-961713 | -7.644491 | -4.311613 | 2.889316 | other | Zr1Sn1Pt1 | 3 | 216 | 64.95 |
mp-1208067 | -8.249721 | -6.487853 | 6.501076 | other | Tm16Cd4Pd4 | 24 | 216 | 606.01 |
mp-1192794 | -8.292793 | -6.564566 | 6.556036 | other | Gd16In4Ir4 | 24 | 216 | 661.78 |
mp-10755 | -6.238056 | -2.631681 | 1.463365 | other | Ti1Fe1Sb1 | 3 | 216 | 53.92 |
mp-1217735 | -7.634401 | -4.542914 | 3.059741 | other | Tb5Sn18Rh6 | 29 | 216 | 689.82 |
mp-631365 | -5.758901 | -3.401144 | -1.64652 | other | Te1Ru1Pb1 | 3 | 216 | 80.8 |
mp-631371 | -7.940811 | -4.994425 | 3.31103 | other | Tl1Cu1Ir1 | 3 | 216 | 59.41 |
mp-1197200 | -9.450635 | -5.524508 | 3.06783 | other | Zn89Cr4Au10 | 103 | 216 | 1,592.74 |
mp-1072041 | -9.576358 | -4.76695 | 3.829427 | other | Gd1Cu4Au1 | 6 | 216 | 89.3 |
mp-15208 | -4.772694 | -1.132107 | -2.93453 | other | Nb4Ga1Se8 | 13 | 216 | 290.35 |
mp-4139 | -4.090842 | -0.133528 | -3.911841 | other | Nb4Ga1S8 | 13 | 216 | 256.67 |
mp-1206021 | 9.500171 | 9.665412 | 0.059176 | other | Zr1Ni4O1 | 6 | 216 | 73.52 |
mp-1212321 | -8.430475 | -6.48285 | 6.861235 | other | Ho16Mg4Ru4 | 24 | 216 | 629.01 |
mp-1217482 | -8.704665 | -0.490011 | 5.024657 | other | Tb1Ho1Co4 | 6 | 216 | 91.07 |
mp-1233139 | -3.987207 | -0.215051 | -4.597428 | other | Mg1Ti4S8 | 13 | 216 | 261.65 |
mp-961731 | -6.524352 | -3.653222 | 3.767078 | other | Nb1In1Ni1 | 3 | 216 | 60 |
mp-962071 | -6.745096 | -7.132401 | 4.79631 | other | Mg1Sc1Tl1 | 3 | 216 | 82.67 |
mp-1212342 | -7.989455 | -6.520165 | 6.743283 | other | Ho16Mg4Co4 | 24 | 216 | 604.11 |
mp-1100442 | 0.451917 | 1.111352 | -3.242712 | other | Ti1Au1Br1 | 3 | 216 | 65.73 |
mp-30349 | -6.60792 | -7.026064 | 2.817471 | other | Li2Ag1Pb1 | 4 | 216 | 74.6 |
mp-1216635 | -7.67949 | -3.54728 | 3.339024 | other | Ti1Sn1Ir1 | 3 | 216 | 58.92 |
mp-1210803 | -8.430074 | -6.334237 | 6.33311 | other | Lu16Cd4Pt4 | 24 | 216 | 589.37 |
mp-2210612 | -4.260675 | -1.546199 | -5.802351 | other | Mg1Cu1S1 | 3 | 216 | 54.74 |
mp-5967 | -6.372725 | -2.671443 | 1.485433 | other | Ti1Co1Sb1 | 3 | 216 | 50.22 |
mp-961701 | -4.315077 | -7.448603 | 3.376528 | other | Zr1Ag1B1 | 3 | 216 | 56.8 |
mp-961684 | -4.705019 | -5.441952 | 0.63326 | other | Li1Ca1As1 | 3 | 216 | 74.58 |
mp-1217470 | -7.064026 | -4.434509 | 6.440822 | other | Tb1Ho1Al4 | 6 | 216 | 119.89 |
mp-631582 | -6.081551 | -1.325686 | 4.028808 | other | Al1Tc2Pb1 | 4 | 216 | 68.82 |
mp-29733 | -6.328909 | -4.931141 | 0.54589 | other | Mg1Ni1Bi1 | 3 | 216 | 59.75 |
mp-1215020 | -9.278399 | -5.177566 | 2.968229 | other | Al4Zn78Pd18 | 100 | 216 | 1,507.96 |
mp-1103718 | -4.891402 | 0.250521 | -4.85922 | other | Al1V4S8 | 13 | 216 | 229.05 |
mp-962077 | 0.714319 | 1.261239 | -3.082979 | other | Ti1Au1Cl1 | 3 | 216 | 59.2 |
mp-961692 | -6.186976 | -3.488082 | 3.631687 | other | Ta1In1Ni1 | 3 | 216 | 59.53 |
mp-961698 | -3.335398 | -4.130178 | 0.718602 | other | Li1Zn1P1 | 3 | 216 | 47.07 |
mp-1025116 | -9.548997 | -4.85394 | 4.009739 | other | Tm1Cu4Ag1 | 6 | 216 | 86.77 |
mp-35267 | -4.623469 | -1.10558 | -6.099415 | other | Al5Cu1S8 | 14 | 216 | 245.9 |
mp-505599 | -6.382384 | -2.95099 | 0.887324 | other | V1Ni1Sb1 | 3 | 216 | 51.55 |
mp-1206681 | -6.685421 | -5.034817 | 0.732135 | other | Sc1Bi1Pd1 | 3 | 216 | 67.98 |
mp-510113 | -6.615329 | -4.317372 | 0.874251 | other | Mn10Ni4Bi8 | 22 | 216 | 435.35 |
mp-631487 | -7.291081 | -1.858612 | 4.581012 | other | La1Be1Os2 | 4 | 216 | 68.92 |
mp-1220051 | -7.02447 | -4.475482 | 6.42221 | other | Nd1Ho1Al4 | 6 | 216 | 123.75 |
mp-1212869 | 4.423455 | 2.488026 | -3.191938 | other | Fe1Cu2C12 | 15 | 216 | 252.05 |
mp-1210653 | -8.663445 | -6.357538 | 6.558751 | other | Lu16Cd4Ir4 | 24 | 216 | 583.47 |
mp-1100431 | 0.416047 | 1.292658 | -4.400559 | other | Sr1Br1Cl1 | 3 | 216 | 95.07 |
mp-567347 | -7.0062 | -6.758014 | 2.676216 | other | Li2Ag1Sn1 | 4 | 216 | 69.82 |
mp-1208458 | -7.623447 | -6.559242 | 6.612651 | other | Tb16Mg4Ni4 | 24 | 216 | 631.52 |
mp-1206307 | -8.971785 | -1.554848 | 2.874094 | other | Yb1In1Ni4 | 6 | 216 | 84.63 |
mp-12009 | -9.472061 | -4.853493 | 3.879107 | other | Yb1Cd1Cu4 | 6 | 216 | 91.67 |
mp-724172 | 6.607783 | 6.515727 | -3.867914 | other | N1Cl1O4 | 6 | 216 | 114.63 |
mp-1212304 | -8.294621 | -6.413656 | 6.611167 | other | Ho16Mg4Rh4 | 24 | 216 | 630.2 |
mp-20889 | -7.372105 | -4.164759 | 2.976955 | other | Hf1Sn1Pt1 | 3 | 216 | 69.2 |
mp-1225587 | -7.476979 | -1.087066 | 5.522556 | other | Dy1Er1Mn4 | 6 | 216 | 93.45 |
mp-5944 | -6.489566 | -4.301792 | 0.797822 | other | Mn1Sb1Au1 | 3 | 216 | 67.4 |
mp-1222166 | 2.996164 | -0.440736 | -1.907195 | other | Mg1Ti2H6 | 9 | 216 | 72.99 |
mp-961707 | -5.833052 | -4.764479 | 1.122103 | other | La1Ni1Sb1 | 3 | 216 | 81.69 |
mp-1207802 | -8.332971 | -6.561885 | 6.661237 | other | Y16Cd4Ir4 | 24 | 216 | 635.08 |
mp-962057 | -4.051446 | -5.975722 | 5.013277 | other | Sr1Ca1Si1 | 3 | 216 | 96.57 |
mp-631405 | 0.668935 | 1.205965 | -2.160629 | other | Zr1Tc1Cl1 | 3 | 216 | 53.71 |
mp-631344 | -4.41699 | -2.900104 | -3.498946 | other | Na1Os1Se2 | 4 | 216 | 72.54 |
mp-631381 | -6.134295 | -2.487849 | -0.871849 | other | Te1Ru1Se1 | 3 | 216 | 65.71 |
mp-1210733 | -8.364405 | -6.332811 | 6.489237 | other | Lu16Mg4Rh4 | 24 | 216 | 599.57 |
mp-1062306 | -7.164957 | -1.312406 | 3.296812 | other | Mn1Si1Ni1 | 3 | 216 | 40.74 |
mp-1100429 | -4.820948 | -6.290884 | 0.797197 | other | K1Sr1Sb1 | 3 | 216 | 121.7 |
mp-1072944 | -9.367502 | -4.573971 | 3.798462 | other | Sc1Cu4Sn1 | 6 | 216 | 89.66 |
mp-631575 | -5.170667 | -5.841935 | 3.078334 | other | Ti1Cr1Ag1 | 3 | 216 | 56.95 |
mp-546118 | 6.504644 | 5.870484 | -3.482605 | other | Na1Cl1O4 | 6 | 216 | 100.49 |
mp-1100405 | -6.235799 | -2.883797 | -0.452845 | other | Sc1Te1Rh1 | 3 | 216 | 62.03 |
mp-1017515 | -6.679469 | -1.229499 | 1.987527 | other | Mn2Co1As1 | 4 | 216 | 47.33 |
mp-961704 | -7.236224 | -4.828321 | 3.67333 | other | Nb1Tl1Pt1 | 3 | 216 | 64.99 |
mp-1072653 | -9.155712 | -4.631876 | 4.114625 | other | U1Cu4Ag1 | 6 | 216 | 91.62 |
mp-961710 | -5.959329 | -3.706186 | 4.493498 | other | V1Si1Pt1 | 3 | 216 | 49.35 |
mp-567342 | -8.027242 | -6.621602 | 6.782036 | other | Nd16Mg4Ir4 | 24 | 216 | 709.74 |
mp-1219727 | -7.621088 | -0.02769 | 5.781783 | other | Pr1Sm1Fe4 | 6 | 216 | 103.9 |
mp-631299 | -6.577696 | -1.489486 | 4.296589 | other | Nb1Cr1Co1 | 3 | 216 | 49.81 |
mp-631467 | -3.135517 | -5.187047 | 6.262746 | other | Be1In1Si2 | 4 | 216 | 66.38 |
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