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-622086
-2.780807
-2.4052
-5.649126
other
La8Ge4S20
32
14
766.41
mp-554821
7.557052
6.605986
-3.05432
other
Tb4I12O36
52
14
776.53
mp-776224
11.783131
12.801534
-2.938399
other
Li12V20O48
80
14
1,034.14
mp-766343
-1.251964
1.905393
-1.621596
other
Ba8Ca4I24
36
14
1,754.88
mp-1407692
8.030265
9.272499
-3.057083
other
Te2Ir2O12
16
14
191.86
mp-30978
-0.343682
1.112934
-4.330272
other
K4Al8Br28
40
14
1,419.8
mp-1203379
6.041111
5.44361
-3.914678
other
Sb16Cl56O48
120
14
3,060.88
mp-29072
-5.447052
-2.249647
-1.632894
other
Nb8Si4Te16
28
14
759.66
mp-779000
9.424366
8.530287
-0.074367
other
Rb16Sb4O16
36
14
827.92
mp-752901
9.978595
2.581027
1.971541
other
Li6V4F16
26
14
315.68
mp-1195141
-2.98999
-2.523642
-4.315434
other
Sr4U8S20
32
14
734.25
mp-771831
1.076748
1.713278
-5.222984
other
Sr8La4Cl28
40
14
1,204.06
mp-756703
8.728335
6.795455
-3.819487
other
Cd4Se4O16
24
14
320.63
mp-1226075
9.503688
11.683417
-1.76705
other
Co4Te4O16
24
14
265.38
mp-1204022
7.122043
7.309723
-4.05174
other
U4Cl8O60
72
14
1,413.21
mp-769317
10.204952
10.627424
3.311869
other
Ca16Ta8O36
60
14
769.19
mp-1179610
9.883814
9.853003
-1.881353
other
Sb16Te16O72
104
14
1,563.45
mp-752406
9.148676
8.498378
0.422248
other
Rb12Tm4O12
28
14
651.58
mp-556548
13.933055
4.256429
-2.453518
other
Bi4B12O24
40
14
412.55
mp-29360
13.142097
7.906507
-7.289313
other
Cr8P16O52
76
14
947.8
mp-1181186
4.412566
2.497504
-3.174745
other
K4C8N12
24
14
576.68
mp-1210759
9.613428
10.892989
-3.032904
other
Lu4W4O20
28
14
397.99
mp-17015
10.454872
8.3684
0.054871
other
K16Ge4O16
36
14
666.92
mp-1193081
8.959067
9.370621
-0.46915
other
Cs12Cr4O14
30
14
703.69
mp-27535
7.626115
6.608617
-2.986469
other
Ca4I8O24
36
14
563.33
mp-26218
14.003572
7.930699
-6.921081
other
Cr6P8O28
42
14
518.92
mp-1195370
-4.043245
-3.683086
-2.88332
other
Ba4U8Se20
32
14
873.42
mp-573568
-1.165386
2.685712
-2.862371
other
K4Tc2I12
18
14
730.42
mp-581963
-5.846435
-3.199314
-1.773947
other
K16Hf12Te68
96
14
3,491.39
mp-626470
11.738153
4.185328
-3.778558
other
Al8H24O24
56
14
431.56
mp-1217751
-4.265307
-4.151305
-3.769304
other
Tb12Cu4Se24
40
14
947.08
mp-1214972
6.182794
5.548309
-4.310928
other
Co4N16O40
60
14
1,119.01
mp-1047521
9.102821
8.013397
-4.137748
other
Bi6As8O32
46
14
803.82
mp-729172
8.510642
6.206684
-5.7602
other
Zr4S8O36
48
14
747.84
mp-28014
10.257896
3.045191
-3.956763
other
H20Br4O8
32
14
349.87
mp-1181459
8.714636
1.395439
-4.131473
other
H48S8N16
72
14
782.59
mp-1198839
7.19561
5.189503
-4.855184
other
U4C8O36
48
14
826.47
mp-754397
7.591427
10.457861
-0.543472
other
Na12Co4O12
28
14
421.2
mp-1347225
10.675196
9.732818
0.144223
other
Mg4Sb4O12
20
14
244.89
mp-989620
1.4968
1.921859
2.219189
other
La4Ta4N12
20
14
277.67
mp-12181
-3.088762
-1.899272
-5.498046
other
Ba4Sn4S8
16
14
478.39
mp-643392
10.777854
4.267358
-3.901458
other
Ca4H8O8
20
14
187.65
mp-1044194
9.885595
10.405191
-3.833257
other
Bi4Mo4O20
28
14
577.34
mp-18464
10.051348
8.320103
-0.089063
other
Rb16Ge4O16
36
14
752.74
mp-724995
1.789566
2.487173
-3.599398
other
Li4Br4N4
12
14
303.82
mp-769404
10.129517
7.061757
-3.005382
other
Y8Se8O24
40
14
621.1
mp-616597
9.945818
10.668452
-3.418682
other
Re4Hg4O16
24
14
413.19
mp-626994
10.648942
4.027121
-3.528056
other
Ba8H16O16
40
14
527.38
mp-541236
-4.733138
-5.484425
0.55095
other
Na20Hf4As12
36
14
869.11
mp-729080
8.312594
2.456821
-1.307977
other
Hf4O12F16
32
14
467.31
mp-541688
-5.975278
-3.594765
-2.043469
other
K12Ga4Te12
28
14
1,070.63
mp-29612
-1.187055
2.281566
-2.126154
other
Rb4Eu8I20
32
14
1,307.97
mp-27283
1.36596
2.270709
-5.275453
other
Tl4Pb8Cl20
32
14
898.17
mp-1199849
13.342038
5.87734
-6.848882
other
Dy12P36O108
156
14
2,348.96
mp-1180567
6.308257
5.626951
-4.305592
other
Mg2N4O24
30
14
566.2
mp-26838
13.451925
8.738659
-5.77104
other
Mo4P8O28
40
14
534.25
mp-1213548
6.799874
6.12307
-3.76923
other
Dy4I4O36
44
14
717.77
mp-1191983
8.182551
6.587125
-5.192368
other
Mg4S4O16
24
14
357.36
mp-17336
-4.467133
-3.352017
-3.202809
other
Np4Cu4Se8
16
14
341.78
mp-1178128
7.239978
11.061882
2.065434
other
La12Mn4O28
44
14
597.43
mp-1202364
9.336248
7.095737
-3.305778
other
Mn8Se8O24
40
14
571.64
mp-1221391
-2.546324
0.521653
2.570522
other
Nd50B28C52
130
14
2,127.37
mp-780146
12.989825
0.689069
1.927003
other
Fe6O4F8
18
14
216.5
mp-1006619
13.613894
7.172289
-5.168004
other
Sn12P4O24
40
14
667.25
mp-767539
-5.092529
-3.253706
-3.243909
other
Li24Sb4S8
36
14
659.14
mp-768833
8.536521
9.407475
-0.186026
other
Rb32Fe8O28
68
14
1,497.09
mp-31512
7.001791
9.980795
-0.696953
other
Rb28Fe8O32
68
14
1,460.35
mp-770065
10.176698
9.737774
3.168996
other
Gd8Ti4O20
32
14
460.76
mp-770516
11.682024
11.189066
-2.555069
other
Tb8W12O48
68
14
1,495.53
mp-772821
9.195769
8.493701
0.485171
other
Rb12Lu4O12
28
14
644.09
mp-753819
7.741817
13.431671
-1.111709
other
Mn4Tl4O12
20
14
242.42
mp-728988
7.074154
6.250546
-4.006199
other
U8Cl8O40
56
14
1,014.28
mp-540050
13.674646
8.11696
-6.688437
other
Fe12P12O44
68
14
866.52
mp-1196159
-5.139071
-3.534033
5.731348
other
Tm10Co8Si28
46
14
731.49
mp-1201996
6.110585
5.147823
-4.498518
other
Pu2N16O36
54
14
689.82
mp-27066
10.589901
8.355346
-7.694794
other
Mn12P12O48
72
14
889.49
mp-1214882
1.353182
2.445756
-3.332709
other
Au4I12N4
20
14
799.14
mp-1211714
8.211012
0.905284
1.758158
other
K6Ho2F12
20
14
364.49
mp-30981
10.22365
4.442178
-4.070458
other
Te4H24O24
52
14
481.93
mp-722237
5.666569
-0.116569
-3.030708
other
Be4B24H64
92
14
1,163.1
mp-1210966
11.35744
11.077436
-3.958916
other
Lu4Mo8O30
42
14
671.11
mp-556419
8.605242
2.44155
-1.135204
other
Re4O8F12
24
14
331.49
mp-1194786
-1.218177
2.729512
-2.796219
other
Rb12Bi8I36
56
14
2,735.37
mp-1101894
-5.484123
-1.83699
-2.986617
other
Fe4As4Se4
12
14
188.06
mp-1047807
10.862576
11.159662
-2.895339
other
Cu8W8O32
48
14
747.2
mp-1202578
12.681861
10.576092
0.462489
other
Nd32Mo42O112
186
14
2,534.35
mp-1226070
-4.934831
-0.951186
-4.484924
other
Co2Cu2S8
12
14
179.56
mp-17418
8.568452
1.384502
0.905862
other
Sm4Sn4F28
36
14
547.56
mp-18341
8.438785
1.590748
0.03761
other
Er4Pt4F28
36
14
489.57
mp-27141
11.578363
4.58375
-4.854689
other
P8H32O36
76
14
682.57
mp-773008
11.706597
11.232068
-2.564063
other
Er8W12O48
68
14
1,447.96
mp-1211516
1.07924
1.802755
-5.287149
other
K4Sm8Cl28
40
14
1,170.04
mp-1196168
7.857983
10.268094
-1.002359
other
Ba8W4O24
36
14
637.31
mp-9278
-5.778893
-1.736994
4.256498
other
U4Si8W6
18
14
301.24
mp-26462
10.105015
9.213151
-6.416835
other
V4P4O20
28
14
351.61
mp-1211484
1.105272
1.828889
-5.281645
other
K4Tm8Cl28
40
14
1,084.45
mp-770558
10.301805
8.313781
-7.21493
other
Mn4P8O28
40
14
455.81
mp-777744
8.446216
1.256109
1.839613
other
Ba8Y4F28
40
14
667.95
mp-776610
-1.300518
1.952307
-1.599465
other
Ba24Y4I60
88
14
5,718.62
mp-554649
9.186139
0.639433
-0.011891
other
Na6Ni2F12
20
14
234.3