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-1190528
-4.442146
-3.43011
-3.900212
other
Ba8Zn4Se12
24
62
730.29
mp-1191273
-7.120673
-4.550866
5.806605
other
Tb12Ni4Ge8
24
62
538.97
mp-540578
1.422368
2.730049
-6.023387
other
Cs8Zn4Cl16
28
62
945.45
mp-756224
9.841446
8.362378
3.238031
other
Tb4Gd4O12
20
62
296.32
mp-19379
9.599277
5.139864
-6.492181
other
Co4S4O16
24
62
270.06
mp-1200132
-7.604947
-1.879616
3.033065
other
Ho4Si12Ni20
36
62
469.47
mp-1181002
7.938376
11.070626
1.361496
other
La4Fe4O12
20
62
302.65
mp-1232116
-2.716008
-2.699886
-5.813148
other
Lu8Mg4S16
28
62
664.41
mp-1247116
-6.011306
-3.438421
-2.141882
other
In16Te12N8
36
62
981.92
mp-1102053
-8.326745
-5.067252
3.790831
other
Ce4Ga4Pd4
12
62
251.72
mp-1247538
0.877955
1.966662
2.321368
other
Zr4Mn4N8
16
62
209.52
mp-1208378
-9.517377
-4.620771
3.82779
other
Tb4Cu20Sn4
28
62
435.95
mp-22636
-6.533544
-1.541488
3.28208
other
Ta4Ni4Ge4
12
62
167.99
mp-1193604
1.449045
2.61284
-6.009936
other
Cs8Be4Cl16
28
62
876.09
mp-1199038
-5.999012
-0.461955
1.434694
other
Ho4Co20P12
36
62
437.12
mp-771957
10.986459
11.594551
2.850661
other
Ta8Pb4O24
36
62
484.19
mp-1106103
5.151393
0.0082
-2.566701
other
Ca4B8H4
16
62
185.66
mp-3792
10.95884
8.220645
2.230031
other
Y4Al4O12
20
62
202.91
mp-23553
10.907033
7.995501
-1.331746
other
Ge4Bi8O20
32
62
492.96
mp-1199431
-2.712382
-2.609616
-5.626322
other
Ho8Zr4S20
32
62
644.7
mp-1229262
7.555212
8.051617
-3.519551
other
Al12P8O64
84
62
1,249.57
mp-1209362
1.103347
1.923297
-5.348049
other
Rb4Gd8Cl28
40
62
1,177.56
mp-9186
9.397064
6.990192
-3.403193
other
Cd4Se4O12
20
62
273.49
mp-617407
1.352015
2.158786
-5.596978
other
Na8Eu4Cl20
32
62
839.73
mp-4626
8.587869
3.681519
-6.943174
other
Ca4C4O12
20
62
234.24
mp-1211957
8.406362
1.075593
1.832841
other
K8Lu4F20
32
62
489.28
mp-1194123
-4.523897
-3.788502
-3.854102
other
Yb8Pb4Se16
28
62
779.9
mp-29405
-1.25405
2.977225
-2.898161
other
Rb4Sn4I12
20
62
862.58
mp-1201621
-3.877485
-3.960997
-3.322047
other
La8U4Se20
32
62
856.48
mp-27865
1.304004
2.356605
-5.704395
other
K4Mg4Cl12
20
62
482.72
mp-652608
-3.424729
0.415763
2.589848
other
U4W4C8
16
62
199.99
mp-779156
8.853861
6.686791
-3.81348
other
Cd4Se4O16
24
62
353.33
mp-22101
-5.418563
-2.576726
6.031468
other
Dy4Mn4Si4
12
62
216.29
mp-21365
-3.798908
-1.314717
-5.342464
other
In4Sb4S12
20
62
490.59
mp-603934
-4.994179
-0.922752
-5.222185
other
Fe8Cu4S12
24
62
430.72
mp-1211295
-0.203716
0.79472
-3.678023
other
K4Tm4Br12
20
62
663.89
mp-18229
10.745973
11.561777
3.235217
other
Ca4Ta8O24
36
62
448.64
mp-23366
-0.545441
1.253643
-4.832616
other
Rb8Co4Br16
28
62
989.57
mp-504821
-0.473903
1.340944
-4.466273
other
Tl4Fe4Br12
20
62
577.94
mp-1247171
1.636445
1.80917
1.18217
other
Ba16C4N16
36
62
836.65
mp-1103158
-7.562523
-2.286618
3.966652
other
Ti4Ge4Ir4
12
62
183.09
mp-1029251
0.744928
2.29435
1.863936
other
Li4Ru4N4
12
62
136.36
mp-23977
-1.835211
-0.226384
-4.830399
other
H4S28N4
36
62
958.26
mp-1207644
-1.704668
0.110372
2.064024
other
Yb8Re4C8
20
62
347.8
mp-3119
11.98693
9.799884
2.311594
other
Nd4Ti4O12
20
62
248.05
mp-21003
-2.707785
0.529434
2.52815
other
Y8Re4C8
20
62
332.96
mp-29068
-5.331745
-3.47921
3.289988
other
Hf20Fe4Te12
36
62
880.69
mp-1212757
6.013718
11.699429
0.100299
other
Eu4Co4O12
20
62
211.82
mp-1194208
-3.098476
-2.277869
-5.260172
other
Sr4Yb8S16
28
62
699.27
mp-1179513
7.254322
6.953373
-4.36646
other
Tl8S8O60
76
62
1,215.54
mp-628664
-3.991436
-3.922012
0.864408
other
Ce8P12Au4
24
62
523.93
mp-504269
9.793562
7.722779
-6.250414
other
Ni4P16O48
68
62
937.15
mp-1105914
3.33549
-0.688275
-2.441303
other
K4Ca4H12
20
62
356.49
mp-5158
6.256836
4.887688
-4.487315
other
K4N4O12
20
62
306.25
mp-3075
-3.630639
-1.478792
-5.638949
other
Tl8Ge8S16
32
62
854.48
mp-1211691
8.242133
0.961436
1.821985
other
K8Tb4F20
32
62
510.44
mp-1103678
-3.276716
-2.931171
-4.064315
other
Gd4Sb4S4
12
62
296.55
mp-1195229
8.317761
2.250522
-0.780614
other
Sb4Xe4F44
52
62
876.24
mp-1211863
-0.293537
0.964202
-4.062669
other
K8Nd4Br20
32
62
1,042.27
mp-541593
8.597784
1.49275
1.129268
other
Zr4Pb8F32
44
62
646.42
mp-623295
-8.023585
-4.302155
5.843733
other
Sm4Ga4Co4
12
62
256.74
mp-1232272
-2.664459
-2.638484
-5.65936
other
Pm8Mg4S16
28
62
742.06
mp-731593
-0.927396
2.182464
-2.795523
other
Yb4I8O4
16
62
495.25
mp-22341
7.77183
11.2033
1.501832
other
Pr4Fe4O12
20
62
242.46
mp-1193355
-3.842377
-1.360896
-5.773136
other
Mg8Sn4S16
28
62
611.94
mp-1194726
8.888093
6.945809
-3.78021
other
Li8Se8O28
44
62
639.99
mp-757315
5.383288
10.944145
-1.923234
other
Na8Fe8O20
36
62
436.67
mp-1183521
-5.334527
-6.00651
3.488008
other
Ca12Si4O4
20
62
417.5
mp-1213731
1.247162
2.439086
-6.033975
other
Cs8Gd4Cl20
32
62
1,116.32
mp-28830
-0.167168
1.140647
-4.419283
other
Na8Zn4Br16
28
62
824.3
mp-1192902
-4.491562
-1.527737
-5.619132
other
Tl8Cu8S12
28
62
640.03
mp-1196064
7.724222
7.558557
-4.350163
other
Cu8B4O24
36
62
437.15
mp-1188749
-8.612796
-4.948469
3.335002
other
Tb4Ga4Pd8
16
62
291.82
mp-1238799
-5.255009
-0.167363
-5.698175
other
Rb4Cr8S16
28
62
675.82
mp-1201912
-2.905669
-2.683247
-4.846677
other
Ce8Th4S20
32
62
764.24
mp-768335
-4.760479
-0.968527
-5.233994
other
Li12Fe8S16
36
62
622.42
mp-29903
8.382864
1.825478
-0.264163
other
Tl4Te4F20
28
62
480.84
mp-1205232
7.816516
6.710476
-4.608239
other
Ba4Si8O36
48
62
674.4
mp-1209166
-1.172473
2.035733
-1.850111
other
Rb4Tm4I12
20
62
795.51
mp-1213011
-6.731699
-3.24365
1.001866
other
Er4Sb4Ir4
12
62
249.22
mp-28877
-5.93758
-3.529413
-1.838535
other
Cs8Sn4Te16
28
62
1,224.12
mp-22212
9.538519
9.807874
-1.075661
other
Na4Sb4O12
20
62
236.38
mp-504814
-3.415105
-1.669656
-5.366107
other
Sb8Pb8S20
36
62
932.77
mp-1103069
-7.688232
-4.209646
3.519403
other
Tm4Co4Sn4
12
62
237.26
mp-1101867
-7.444617
-4.857492
3.286854
other
Zr4Cu4Sn4
12
62
223.52
mp-1208146
2.790586
3.020288
-4.132684
other
V4N12Cl20
36
62
1,111.5
mp-20811
-5.773496
-2.774436
5.203353
other
U4Co4Si4
12
62
198.51
mp-1190574
-2.751394
-2.873172
-4.39817
other
Ho8P8S8
24
62
469.89
mp-22249
-6.256945
-3.80777
0.922345
other
Ce4Sb4Rh4
12
62
270.98
mp-22031
-7.638666
-5.799105
2.945215
other
Eu4Sn4Pd4
12
62
285.78
mp-1213876
11.784604
11.045694
-2.930716
other
Co16Mo12O48
76
62
979.64
mp-30196
-3.909826
-3.751367
0.812513
other
Er4Cu4P8
16
62
264.33
mp-540688
9.89852
8.815712
0.929477
other
Sr4In8O16
28
62
373.98
mp-8952
-6.116064
-3.842164
0.668417
other
Ho4As4Pd4
12
62
227.19
mp-5185
8.71524
0.81642
1.452111
other
K8Be4F16
28
62
399.74
mp-1048255
11.575826
12.910991
-0.033098
other
Mg4Cr8O16
28
62
276.38
mp-27154
9.016595
0.842897
1.058215
other
Rb8Cr4F20
32
62
513.26
mp-1202948
-3.216787
-4.380095
0.872413
other
Ba12Al8P16
36
62
995.78
mp-779893
13.095777
6.503656
-6.880908
other
Dy4P20O56
80
62
1,028.75
mp-504477
5.663085
3.319996
-4.572088
other
V4C24O24
52
62
985.58