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-556044 | 13.62352 | 6.574087 | -0.931611 | other | Si12O24 | 36 | 163 | 680.65 |
mp-1080030 | 5.646677 | 2.091421 | -2.576834 | other | B1C7 | 8 | 156 | 47.46 |
mp-557009 | -4.841799 | -1.743453 | -6.704895 | other | Zn20S20 | 40 | 156 | 781.95 |
mp-555628 | -4.841909 | -1.743944 | -6.705517 | other | Zn24S24 | 48 | 156 | 938.63 |
mp-680133 | -1.194655 | 2.838751 | -3.002913 | other | Cd17I34 | 51 | 156 | 2,040.37 |
mp-582042 | -1.187797 | 2.845014 | -3.005517 | other | Cd15I30 | 45 | 156 | 1,895.14 |
mp-570985 | -1.155855 | 0.557724 | 2.360921 | other | Si27C27 | 54 | 156 | 556.97 |
mp-556815 | -4.84239 | -1.744518 | -6.707016 | other | Zn14S14 | 28 | 156 | 547.58 |
mp-557058 | -4.829134 | -1.751038 | -6.658599 | other | Zn12S12 | 24 | 156 | 494.03 |
mp-556395 | -4.841755 | -1.741804 | -6.703424 | other | Zn8S8 | 16 | 156 | 312.42 |
mp-1216967 | 0.245192 | 2.091187 | 2.27898 | other | W14N12 | 26 | 156 | 310.24 |
mp-1227622 | -5.511863 | -1.420768 | 4.635459 | other | Be46Ru7 | 53 | 156 | 497.03 |
mp-571579 | -1.208347 | 2.842772 | -3.005404 | other | Cd10I20 | 30 | 156 | 1,137.89 |
mp-571516 | -1.189988 | 2.843081 | -3.005251 | other | Cd16I32 | 48 | 156 | 1,988.56 |
mp-571613 | -1.191995 | 2.841646 | -3.004622 | other | Cd12I24 | 36 | 156 | 1,470.59 |
mp-669340 | -1.193175 | 2.83828 | -3.003002 | other | Cd14I28 | 42 | 156 | 1,684.32 |
mp-1227597 | -5.384245 | -1.475078 | 4.729477 | other | Be46Ir7 | 53 | 156 | 498.95 |
mp-1218093 | -7.14779 | -0.502348 | 3.953551 | other | Ta3Co9 | 12 | 156 | 146.59 |
mp-582619 | -1.170529 | 2.81451 | -3.007839 | other | Cd6I12 | 18 | 156 | 719.51 |
mp-571538 | -1.208405 | 2.842822 | -3.005481 | other | Cd10I20 | 30 | 156 | 1,138.57 |
mp-1018649 | 5.642779 | 2.011176 | -2.593371 | other | B1C5 | 6 | 156 | 36.08 |
mp-556155 | -4.841317 | -1.742873 | -6.703457 | other | Zn20S20 | 40 | 156 | 781.82 |
mp-680153 | -1.194881 | 2.83867 | -3.002874 | other | Cd21I42 | 63 | 156 | 2,518.13 |
mp-1228684 | -8.216891 | -3.061825 | 2.246932 | other | B2Pt3 | 5 | 156 | 63.99 |
mp-554999 | -4.841535 | -1.743323 | -6.704259 | other | Zn24S24 | 48 | 156 | 938.38 |
mp-1215293 | -7.191184 | -1.067118 | 4.709226 | other | Zr3Mn9 | 12 | 156 | 164.12 |
mp-1226978 | -8.571597 | -6.036109 | 2.156259 | other | Cd3Au8 | 11 | 156 | 225.31 |
mp-1227672 | -5.438386 | -1.448871 | 4.585391 | other | Be46Rh7 | 53 | 156 | 498.51 |
mp-570437 | -1.208342 | 2.842807 | -3.005517 | other | Cd3I6 | 9 | 156 | 341.65 |
mp-1224450 | -6.075801 | -3.474842 | -2.018291 | other | In2Te3 | 5 | 156 | 192.2 |
mp-554820 | -4.840688 | -1.742229 | -6.701684 | other | Zn28S28 | 56 | 156 | 1,094.4 |
mp-569964 | -1.207791 | 2.842447 | -3.006016 | other | Cd8I16 | 24 | 156 | 912.74 |
mp-1354141 | 5.832296 | 11.733682 | -1.666262 | other | Ni12O24 | 36 | 156 | 380.56 |
mp-1044853 | 10.881018 | 12.524403 | 2.05565 | other | Ti12O24 | 36 | 156 | 459.97 |
mp-1358572 | 9.25677 | 13.293466 | -2.032881 | other | Cr12O24 | 36 | 156 | 439.83 |
mp-569468 | -1.186503 | 2.846454 | -3.005711 | other | Cd16I32 | 48 | 156 | 2,049.81 |
mp-569611 | -1.193105 | 2.840881 | -3.004236 | other | Cd17I34 | 51 | 156 | 2,068.85 |
mp-1359814 | 9.692707 | 9.752854 | -0.153835 | other | Sn12O24 | 36 | 156 | 559.43 |
mp-680152 | -1.191467 | 2.837425 | -3.003105 | other | Cd15I30 | 45 | 156 | 1,807.58 |
mp-570791 | -1.155815 | 0.554377 | 2.36161 | other | Si19C19 | 38 | 156 | 391.93 |
mp-627557 | -1.207854 | 2.84229 | -3.005856 | other | Cd9I18 | 27 | 156 | 1,027.59 |
mp-557418 | -4.841811 | -1.743362 | -6.704844 | other | Zn20S20 | 40 | 156 | 781.89 |
mp-556950 | -4.841558 | -1.74315 | -6.704159 | other | Zn16S16 | 32 | 156 | 625.5 |
mp-554253 | -4.841234 | -1.744656 | -6.704807 | other | Zn26S26 | 52 | 156 | 1,017.71 |
mp-571568 | -1.20815 | 2.842629 | -3.005684 | other | Cd8I16 | 24 | 156 | 912.14 |
mp-571136 | -1.208045 | 2.842684 | -3.005851 | other | Cd7I14 | 21 | 156 | 798.24 |
mp-680092 | -1.208338 | 2.843043 | -3.005707 | other | Cd10I20 | 30 | 156 | 1,138.28 |
mp-555779 | -4.840899 | -1.742861 | -6.702627 | other | Zn16S16 | 32 | 156 | 625.59 |
mp-680120 | -1.207586 | 2.840124 | -3.006352 | other | Cd15I30 | 45 | 156 | 1,738.1 |
mp-570610 | -1.20799 | 2.841985 | -3.005475 | other | Cd13I26 | 39 | 156 | 1,487.74 |
mp-553916 | -4.841144 | -1.742784 | -6.703043 | other | Zn24S24 | 48 | 156 | 938.21 |
mp-684676 | -4.370128 | -1.206319 | -6.111085 | other | Al48S72 | 120 | 156 | 2,266.23 |
mp-571583 | -1.208564 | 2.842789 | -3.005191 | other | Cd10I20 | 30 | 156 | 1,138.13 |
mp-571595 | -1.208327 | 2.842966 | -3.005784 | other | Cd10I20 | 30 | 156 | 1,133.65 |
mp-556543 | -4.840585 | -1.743652 | -6.702684 | other | Zn22S22 | 44 | 156 | 860.82 |
mp-570613 | -1.207619 | 2.840195 | -3.005759 | other | Cd6I12 | 18 | 156 | 691.93 |
mp-555666 | -4.841216 | -1.743114 | -6.703465 | other | Zn32S32 | 64 | 156 | 1,251.2 |
mp-570511 | -1.20746 | 2.839923 | -3.006561 | other | Cd5I10 | 15 | 156 | 579.7 |
mp-1217101 | -3.924007 | -0.248874 | -4.019366 | other | Ti3S4 | 7 | 156 | 121.36 |
mp-775808 | 16.728468 | 9.647991 | 7.403878 | other | Mg6O6 | 12 | 156 | 142.18 |
mp-556485 | -4.827733 | -1.749528 | -6.663173 | other | Zn12S12 | 24 | 156 | 495.39 |
mp-554986 | -4.841123 | -1.782731 | -6.726696 | other | Zn34S34 | 68 | 156 | 1,376.74 |
mp-571603 | -1.208517 | 2.843252 | -3.005562 | other | Cd12I24 | 36 | 156 | 1,363.83 |
mp-570263 | -1.190176 | 2.843007 | -3.005102 | other | Cd9I18 | 27 | 156 | 1,117.24 |
mp-680118 | -1.207591 | 2.840169 | -3.006354 | other | Cd15I30 | 45 | 156 | 1,738.09 |
mp-752998 | 11.724351 | 8.533546 | 1.903743 | other | U3O5 | 8 | 156 | 119.82 |
mp-556161 | -4.84169 | -1.74356 | -6.704773 | other | Zn14S14 | 28 | 156 | 547.44 |
mp-1094219 | -6.767744 | -9.301489 | 3.431696 | other | Mg3Sn3 | 6 | 156 | 149.16 |
mp-1041066 | 8.074808 | 13.990758 | -1.755566 | other | Mn12O24 | 36 | 156 | 429.92 |
mp-553880 | -4.841306 | -1.744215 | -6.704576 | other | Zn26S26 | 52 | 156 | 1,017.34 |
mp-1096941 | -4.644985 | -1.420997 | -5.33987 | other | Cu1S1 | 2 | 156 | 60.48 |
mp-554608 | -4.840883 | -1.744105 | -6.703653 | other | Zn26S26 | 52 | 156 | 1,017.49 |
mp-1041256 | 5.910555 | 11.550359 | -1.643408 | other | Ni12O24 | 36 | 156 | 386.38 |
mp-555782 | -4.841319 | -1.742863 | -6.703449 | other | Zn20S20 | 40 | 156 | 781.82 |
mp-571037 | -1.208203 | 2.842752 | -3.005691 | other | Cd7I14 | 21 | 156 | 796.54 |
mp-647075 | -4.840226 | -1.783107 | -6.725253 | other | Zn64S64 | 128 | 156 | 2,593.36 |
mp-680148 | -1.193303 | 2.836776 | -3.002985 | other | Cd20I40 | 60 | 156 | 2,397.4 |
mp-554630 | -4.841177 | -1.745805 | -6.705662 | other | Zn24S24 | 48 | 156 | 940.23 |
mp-995181 | -6.184088 | -5.98811 | 2.600456 | other | Sn1Ge1 | 2 | 156 | 207.55 |
mp-556000 | -4.841036 | -1.744072 | -6.703921 | other | Zn22S22 | 44 | 156 | 860.87 |
mp-1356217 | 9.598911 | 9.759984 | -0.241085 | other | Sn12O24 | 36 | 156 | 535.75 |
mp-624400 | -1.208337 | 2.843282 | -3.005864 | other | Cd10I20 | 30 | 156 | 1,136.8 |
mp-647489 | -1.207559 | 2.840076 | -3.0064 | other | Cd7I14 | 21 | 156 | 811.13 |
mp-582034 | -1.155974 | 0.563223 | 2.359834 | other | Si21C21 | 42 | 156 | 433.22 |
mp-555543 | -4.84114 | -1.742806 | -6.703062 | other | Zn24S24 | 48 | 156 | 938.23 |
mp-571593 | -1.207426 | 2.840276 | -3.006854 | other | Cd12I24 | 36 | 156 | 1,391.09 |
mp-571605 | -1.208356 | 2.842583 | -3.005302 | other | Cd10I20 | 30 | 156 | 1,139.1 |
mp-703595 | -1.165596 | 2.786786 | -3.023988 | other | Cd13I28 | 41 | 156 | 1,669.9 |
mp-669357 | -1.207933 | 2.842521 | -3.005904 | other | Cd11I22 | 33 | 156 | 1,255.24 |
mp-680196 | -1.199263 | 2.838043 | -3.003344 | other | Cd29I58 | 87 | 156 | 3,448.56 |
mp-554713 | -4.841969 | -1.743535 | -6.705288 | other | Zn24S24 | 48 | 156 | 938.33 |
mp-680114 | -1.191822 | 2.836334 | -3.003116 | other | Cd11I22 | 33 | 156 | 1,322.03 |
mp-571514 | -1.208048 | 2.842631 | -3.005804 | other | Cd8I16 | 24 | 156 | 912.07 |
mp-680094 | -1.191701 | 2.836767 | -3.003091 | other | Cd11I22 | 33 | 156 | 1,323.21 |
mp-1380335 | 10.903782 | 12.614572 | 2.013911 | other | Ti12O24 | 36 | 156 | 464.13 |
mp-571660 | -1.189553 | 2.843582 | -3.005234 | other | Cd12I24 | 36 | 156 | 1,495.21 |
mp-669358 | -1.191805 | 2.836513 | -3.003122 | other | Cd11I22 | 33 | 156 | 1,322.4 |
mp-570448 | -1.188809 | 2.844015 | -3.005345 | other | Cd13I26 | 39 | 156 | 1,628.02 |
mp-680046 | -1.193367 | 2.838385 | -3.003008 | other | Cd14I28 | 42 | 156 | 1,684.04 |
mp-680116 | -1.193518 | 2.838459 | -3.003003 | other | Cd14I28 | 42 | 156 | 1,683.79 |
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