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-31454 | -6.233776 | -3.204007 | 1.557631 | other | Ta1Sb1Ru1 | 3 | 216 | 58.39 |
mp-1211864 | -7.288796 | -6.355015 | 6.224728 | other | La16Cd4Ni4 | 24 | 216 | 708.96 |
mp-1100428 | -4.511106 | -5.085632 | 5.756817 | other | Li1Y1Si1 | 3 | 216 | 73.78 |
mp-1225536 | -7.460939 | -1.134318 | 5.516964 | other | Dy1Tm1Mn4 | 6 | 216 | 92.81 |
mp-1217492 | -8.706006 | -0.674266 | 5.04257 | other | Tb1Nd1Co4 | 6 | 216 | 94.81 |
mp-1226672 | -7.533756 | 0.044778 | 5.360791 | other | Ce1U1Fe4 | 6 | 216 | 85.44 |
mp-1219010 | -6.79036 | -3.778238 | 5.744922 | other | Sm1U1Al4 | 6 | 216 | 121.79 |
mp-631549 | -5.020036 | -6.030445 | 4.463442 | other | Hf1Ge1B2 | 4 | 216 | 55.32 |
mp-631293 | -3.382694 | -3.96859 | 0.518364 | other | Hg1P2Se1 | 4 | 216 | 76.27 |
mp-1077498 | -9.531081 | -4.851988 | 3.975322 | other | Er1Cu4Ag1 | 6 | 216 | 87.16 |
mp-631349 | -5.970654 | -1.111456 | 3.881425 | other | Zn1Tc1Mo1 | 3 | 216 | 53.63 |
mp-1206719 | -6.401963 | -4.855677 | 1.047519 | other | Nd1Ni1Bi1 | 3 | 216 | 71.76 |
mp-961663 | -5.658207 | -3.740959 | -1.993608 | other | Sr1Te1Pd1 | 3 | 216 | 83.07 |
mp-1227226 | -6.747461 | -4.747827 | 5.930283 | other | Ca1Er1Al4 | 6 | 216 | 123.49 |
mp-30404 | -6.045572 | -5.454845 | 0.737888 | other | Li2Sb1Au1 | 4 | 216 | 70.13 |
mp-961697 | -8.540782 | -5.885179 | 3.187521 | other | Sc1Ge1Au1 | 3 | 216 | 62.32 |
mp-1223473 | 5.31719 | -0.368763 | -2.976189 | other | K1B1H4 | 6 | 216 | 72.25 |
mp-1224794 | -7.364201 | 0.79964 | 3.697086 | other | Fe22B6W1 | 29 | 216 | 298.71 |
mp-631577 | -5.487207 | -4.530505 | 0.374599 | other | Bi1As2Os1 | 4 | 216 | 78.11 |
mp-1222610 | -6.154465 | -7.330229 | 3.375189 | other | Li2Mg1Zn1 | 4 | 216 | 67.63 |
mp-961661 | -5.917304 | -4.22435 | 4.838398 | other | Zr1Si1Pd1 | 3 | 216 | 57.15 |
mp-999046 | -6.061959 | -2.877681 | 3.954608 | other | Ti2In1Co1 | 4 | 216 | 64.19 |
mp-1226526 | -7.729989 | -0.082819 | 5.834362 | other | Ce1Pr1Fe4 | 6 | 216 | 101.18 |
mp-1077334 | -8.993195 | -1.261395 | 3.00114 | other | Er1Mn1Ni4 | 6 | 216 | 81.85 |
mp-30816 | -7.588021 | -5.916032 | 3.564178 | other | Li2Al1Pd1 | 4 | 216 | 55.39 |
mp-961672 | -5.306288 | -7.162156 | 3.881987 | other | Sr1Al1Ga1 | 3 | 216 | 95.85 |
mp-1222290 | -6.52717 | -7.066573 | 3.27566 | other | Li1Mg1In2 | 4 | 216 | 88.78 |
mp-631637 | -8.459937 | -11.143012 | 5.523457 | other | Mg2Pb1W1 | 4 | 216 | 81.88 |
mp-961681 | -7.343167 | -3.772092 | 3.071069 | other | Zr1Ge1Pt1 | 3 | 216 | 63.79 |
mp-1100430 | -5.629991 | -5.862449 | 0.625818 | other | Li1Zn1Sb1 | 3 | 216 | 63.85 |
mp-1100416 | -6.167518 | -3.571897 | 2.069206 | other | Ta1Bi1Ru1 | 3 | 216 | 66.66 |
mp-3522 | -5.848564 | -4.961792 | 0.622077 | other | Mg1Cu1Sb1 | 3 | 216 | 59.1 |
mp-1210030 | -7.850751 | -6.683708 | 6.882623 | other | Nd16Mg4Rh4 | 24 | 216 | 705.4 |
mp-1100415 | -6.384562 | -3.453954 | 1.279022 | other | Zr1Sb1Rh1 | 3 | 216 | 62.5 |
mp-631296 | -5.125813 | -7.15882 | 4.501814 | other | K1Hf1Ni1 | 3 | 216 | 68.42 |
mp-1222653 | -6.519 | -7.170065 | 3.175964 | other | Li2Mg1Ag1 | 4 | 216 | 71.86 |
mp-12008 | -9.540638 | -4.825336 | 4.049466 | other | Er1Cd1Cu4 | 6 | 216 | 89.93 |
mp-631478 | -5.579599 | -5.051294 | 1.323577 | other | Ir1Pb1Br1 | 3 | 216 | 80.4 |
mp-631379 | -9.279008 | -4.923646 | 3.615703 | other | Zn1Cu1Mo1 | 3 | 216 | 51.41 |
mp-1071478 | -8.073771 | -3.372526 | 2.690195 | original | Ce1In1Pt4 | 6 | 216 | 110.92 |
mp-631495 | -5.116693 | -7.166558 | 4.420832 | other | Ba1Y1Sc1 | 3 | 216 | 128.81 |
mp-30459 | -6.370923 | -4.607566 | 0.899257 | other | Sc1Ni1Bi1 | 3 | 216 | 60.24 |
mp-1077095 | -9.095497 | -1.511422 | 2.86388 | original | Lu1Cd1Ni4 | 6 | 216 | 84.33 |
mp-568931 | -6.153611 | -4.332869 | 0.912082 | other | Yb1Ni1Sb1 | 3 | 216 | 64.83 |
mp-10182 | -3.307105 | -4.121766 | 0.757471 | other | Li1Zn1P1 | 3 | 216 | 46.3 |
mp-961708 | -7.482076 | -4.101736 | 3.416494 | other | Nb1In1Pt1 | 3 | 216 | 64.75 |
mp-1225531 | -6.760024 | -3.719537 | 5.683379 | other | Dy1U1Al4 | 6 | 216 | 120.42 |
mp-1215207 | -7.565779 | 0.035504 | 5.503556 | other | Zr1Sc1Fe4 | 6 | 216 | 88.16 |
mp-1212975 | -8.316291 | -6.676286 | 6.997713 | other | Dy16Mg4Ru4 | 24 | 216 | 637.21 |
mp-962075 | -5.506682 | -7.19091 | 3.22983 | other | Sr1Mg1Sn1 | 3 | 216 | 110.28 |
mp-1077796 | -8.215903 | -3.422662 | 2.543931 | other | La1In1Pt4 | 6 | 216 | 114.24 |
mp-1221621 | -8.400518 | -2.554578 | 3.817433 | other | Mn1Al1Ir1 | 3 | 216 | 51.71 |
mp-631337 | -4.975333 | -6.838023 | 3.595278 | other | Na1Ta1Ni1 | 3 | 216 | 54.96 |
mp-631518 | -4.795738 | -5.247588 | 4.290257 | other | Zr1B1Te1 | 3 | 216 | 67.96 |
mp-1209720 | -8.030044 | -6.701882 | 6.852878 | other | Pr16Mg4Ir4 | 24 | 216 | 726.44 |
mp-1207810 | -8.068717 | -6.605172 | 6.550048 | other | Y16Mg4Pt4 | 24 | 216 | 665.51 |
mp-1207620 | -6.169304 | -7.120409 | 4.238 | other | Yb16Mg4Cu4 | 24 | 216 | 735.85 |
mp-571185 | -6.068699 | -3.558492 | 1.81962 | other | Hf1Co1Sb1 | 3 | 216 | 62.49 |
mp-961647 | -3.831189 | -5.018879 | 0.801774 | other | Ca1Ag1P1 | 3 | 216 | 74.62 |
mp-623646 | -6.655307 | -3.576029 | 3.137786 | other | Ti1Ni1Sn1 | 3 | 216 | 58 |
mp-5177 | -8.617044 | -6.193828 | 3.033614 | other | Lu1Sn1Au1 | 3 | 216 | 71.54 |
mp-11882 | -8.132565 | -7.594459 | 3.183016 | other | Ti1Cu1Hg2 | 4 | 216 | 71.82 |
mp-631364 | -6.226675 | -3.766024 | 3.825579 | other | Ta1Os1Pb1 | 3 | 216 | 65.73 |
mp-961705 | -7.360258 | -4.429475 | 3.007454 | other | Ti1Pt1Pb1 | 3 | 216 | 64.65 |
mp-1100406 | -6.315849 | -1.970852 | 2.768908 | other | Nb1As1Ru1 | 3 | 216 | 56.13 |
mp-567351 | -8.196552 | -6.382001 | 6.518218 | other | Tb16Mg4Ir4 | 24 | 216 | 648.99 |
mp-546711 | 6.619976 | 5.82223 | -3.332453 | other | Cs1Cl1O4 | 6 | 216 | 120.83 |
mp-1100409 | -5.220107 | -6.005284 | 0.678971 | other | Li1Ca1Sb1 | 3 | 216 | 75.13 |
mp-568800 | -5.761497 | -5.526175 | 0.79456 | other | Cd1Cu1Sb1 | 3 | 216 | 70.65 |
mp-11194 | -9.09207 | -1.556789 | 2.802386 | other | Nd1Mg1Ni4 | 6 | 216 | 86.7 |
mp-1207057 | -6.627087 | -4.744371 | 0.895844 | other | Tm1Bi1Pt1 | 3 | 216 | 73.19 |
mp-1077750 | -9.326315 | -4.44311 | 3.638802 | other | Yb1Cu4Pd1 | 6 | 216 | 85.55 |
mp-631352 | -6.82294 | -3.356187 | 3.484774 | other | Nb1Sn1Ru1 | 3 | 216 | 62.04 |
mp-37405 | -4.932099 | -2.847689 | -4.298536 | other | Al5Cu1Se8 | 14 | 216 | 292.74 |
mp-2988 | -8.192475 | -4.808882 | 3.990699 | other | Li2Ga1Rh1 | 4 | 216 | 52.49 |
mp-961683 | -3.253231 | -4.135977 | 0.646131 | other | Li1Mg1P1 | 3 | 216 | 54.61 |
mp-13434 | -9.078527 | -1.337943 | 2.850087 | other | Ca1Mg1Ni4 | 6 | 216 | 83.71 |
mp-10756 | -6.508582 | -3.164123 | 0.898879 | other | V1Fe1Sb1 | 3 | 216 | 56.09 |
mp-631335 | -5.619448 | -4.277254 | 3.972529 | other | Mg1Ta1Zn1 | 3 | 216 | 58.22 |
mp-554769 | -5.570978 | 1.77001 | -5.031115 | other | Mo4S4Br4 | 12 | 216 | 252.32 |
mp-1210009 | -7.909433 | -6.63944 | 6.596989 | other | Nd16Mg4Pt4 | 24 | 216 | 723.91 |
mp-1071438 | -9.1812 | -1.677029 | 2.69529 | other | Gd1Ni4Au1 | 6 | 216 | 86.58 |
mp-961717 | -8.106843 | -4.165766 | 3.277802 | other | V1In1Pt1 | 3 | 216 | 59.67 |
mp-567636 | -6.509872 | -2.688727 | 1.083282 | other | V1Fe1Sb1 | 3 | 216 | 47.62 |
mp-2885 | -5.238134 | 1.132929 | -4.258447 | other | Ga1Mo4S8 | 13 | 216 | 237.6 |
mp-1212944 | -8.252934 | -6.373319 | 6.096387 | other | Er16Cd4Pd4 | 24 | 216 | 614.36 |
mp-20896 | -9.009684 | -1.590954 | 2.935438 | other | Tm1In1Ni4 | 6 | 216 | 83.44 |
mp-20523 | -6.551352 | -3.747068 | 3.447389 | other | Hf1Ni1Sn1 | 3 | 216 | 62.69 |
mp-1222683 | -7.055712 | -4.66764 | 6.409644 | other | La1Y1Al4 | 6 | 216 | 129.09 |
mp-510613 | -2.531067 | -8.248553 | 1.603347 | other | Mn1Ni1As1 | 3 | 216 | 252.88 |
mp-631541 | -5.009756 | -5.443127 | 4.358967 | other | Be1Ge1B1 | 3 | 216 | 33.81 |
mp-5222 | -3.591197 | 0.421801 | -3.038429 | other | Re4Te4S4 | 12 | 216 | 260.97 |
mp-1100440 | -6.464008 | -6.527418 | 3.497749 | other | Na1Sc1Sn1 | 3 | 216 | 86.02 |
mp-1080382 | -8.183383 | -3.28144 | 2.606066 | other | Er1In1Pt4 | 6 | 216 | 111.22 |
mp-1219707 | -7.031965 | -4.588032 | 6.44253 | other | Pr1Nd1Al4 | 6 | 216 | 129.93 |
mp-1215892 | -6.148855 | -4.748021 | 1.044715 | other | Y1Sb1Pd1 | 3 | 216 | 82.21 |
mp-1100436 | -3.779714 | -5.132499 | 5.940904 | other | Li1In1Si1 | 3 | 216 | 56.9 |
mp-1207056 | -6.435034 | -4.400784 | 0.687266 | other | Y1Sb1Pd1 | 3 | 216 | 71.12 |
mp-1217889 | -5.14239 | -1.419938 | 4.515255 | other | Ta1Ti1Be4 | 6 | 216 | 67.39 |
mp-631270 | -6.51267 | -6.821477 | 2.753511 | other | Zn1Fe1Pb1 | 3 | 216 | 60.04 |
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