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-755328
-6.521571
-4.861825
3.221861
other
Zr2Sn4
6
70
137
mp-20296
-7.824349
-4.702775
3.734677
other
In8Co4
12
70
216.98
mp-1105684
-5.890861
-3.798249
-1.451431
other
Tb8Te12
20
70
712.45
mp-2582
-5.156585
-2.707562
4.572069
other
Ti2Si4
6
70
83.88
mp-1080032
2.430871
2.149581
-0.249506
other
Na4N4
8
70
170.87
mp-2481
-8.084377
-10.357843
5.324962
other
Mg8Cu4
12
70
211.92
mp-1105080
-8.391341
-4.332484
1.994761
other
B2Pd12
14
70
203.87
mp-12383
-5.657259
-3.775163
-1.461738
other
Sc8Te12
20
70
609.01
mp-9824
-4.162691
-4.340387
-3.737569
other
Ho8Se12
20
70
569.23
mp-1189125
-4.248097
-4.330643
-3.727162
other
Lu8Se12
20
70
536.8
mp-568208
1.735343
2.608526
-4.556104
other
Ir4Cl12
16
70
371.07
mp-2131
4.873294
3.027896
-3.348857
other
Sr2N12
14
70
209.07
mp-1189209
-5.837724
-3.772039
-1.620681
other
Ho8Te12
20
70
693.93
mp-10910
-7.268014
-1.724443
5.456497
other
Al4Ru2
6
70
82.44
mp-567982
-6.697944
-4.580338
3.279305
other
Ta4Sn8
12
70
268.69
mp-1189318
-4.233081
-4.296376
-3.728648
other
Tm8Se12
20
70
552.42
mp-569424
-5.859405
0.10427
3.347193
other
Cr8B4
12
70
110.87
mp-22812
-8.353471
-4.64458
4.003584
other
In8Ir4
12
70
240.58
mp-7208
-4.463498
-3.803875
-3.740884
other
Yb8Se12
20
70
589.84
mp-1189540
-4.787988
-3.410508
-3.67431
other
Eu8Se12
20
70
660.35
mp-609
-7.062459
-4.237603
2.52353
other
Cr4Sn8
12
70
233.86
mp-1080273
-4.273627
-4.975058
-3.418368
other
Ce4Se8
12
70
792.06
mp-1205354
-4.077003
-4.094924
-3.746957
other
Sc8Se12
20
70
487.2
mp-1198490
11.230933
9.112379
0.597171
other
U8O24
32
70
494.05
mp-1189748
-5.846442
-3.740845
-1.584351
other
Lu8Te12
20
70
664.62
mp-1188427
-5.837773
-3.78305
-1.590447
other
Dy8Te12
20
70
703.14
mp-567889
-6.007113
-2.898917
4.269531
other
Ti2Ge4
6
70
94.82
mp-28930
5.719305
2.179081
-2.617033
other
K2C16
18
70
223.97
mp-1189791
-5.846487
-3.807508
-1.516239
other
Y8Te12
20
70
708.25
mp-1181290
6.671706
8.880389
-2.439786
other
Ga4O8
12
70
124.94
mp-1072429
-7.851782
-2.221444
4.832556
other
Ga4Ru2
6
70
84.09
mp-570875
-7.876634
-2.467927
5.178757
other
Ga4Os2
6
70
87.77
mp-635966
12.905519
11.092565
-0.99168
other
Mo4O8
12
70
183.34
mp-401
-2.603853
-2.698075
-5.551061
other
Sc8S12
20
70
428.63
mp-1212799
12.450384
9.3797
0.342054
other
Ga8O10
18
70
215.92
mp-555411
13.910649
6.26917
-0.811541
other
Si8O16
24
70
332.65
mp-569857
-3.499367
-4.305077
0.69949
other
K8P12
20
70
574.78
mp-676
5.048906
3.047705
-3.373166
other
Ca2N12
14
70
185.21
mp-1105821
-4.201396
-4.27287
-3.723842
other
Y8Se12
20
70
581.62
mp-1188133
-5.752212
-3.7965
-1.512954
other
Tm8Te12
20
70
678.07
mp-1188185
-4.520615
-3.812025
-3.766255
other
Yb8Se12
20
70
643.78
mp-1189945
-5.893328
-3.785166
-1.846769
other
Yb8Te12
20
70
729.86
mp-568643
5.710466
2.168785
-2.625213
other
Rb2C16
18
70
238.56
mp-581527
-6.630706
-5.134079
0.334511
other
Bi28Rh6
34
70
988.53
mp-14643
-5.833127
-3.805867
-1.558511
other
Er8Te12
20
70
685.62
mp-209
-4.220095
-4.30384
-3.708753
other
Er8Se12
20
70
559.67
mp-1080358
-4.26695
-4.854223
-3.392914
other
Ce8Se16
24
70
1,389.47
mp-555544
15.371121
5.677942
0.167841
other
Si8O16
24
70
396.03
mp-1046
-6.593921
-4.183438
3.032172
other
Nb4Sn8
12
70
271.81
mp-1216444
-6.346298
-0.953368
3.771876
other
V4Os1
5
69
68.33
mp-1227342
-5.602646
-1.144614
4.625369
other
Be2Co1
3
69
27.4
mp-1221484
-6.094327
-0.698626
3.411558
other
Mo2Rh1
3
69
45.96
mp-1226230
-7.591609
0.325467
4.082053
other
Cr1Fe4
5
69
57.25
mp-1216454
-6.428242
-0.948839
3.746943
other
V4Ir1
5
69
68.69
mp-1225135
-7.187873
0.136982
3.711204
other
Fe4Si1
5
69
58.42
mp-1237627
-5.41046
-1.180131
3.430959
other
Te1Mo6
7
69
141.59
mp-1215171
-6.07929
-1.468676
3.964238
other
Zr1W2
3
69
53.67
mp-1061772
-5.614186
-2.953086
3.750226
other
Mg1Nb2
3
69
57.45
mp-1216675
-5.82589
-1.177797
3.704246
other
Ti1Mo2
3
69
47.47
mp-1009830
-4.680372
-2.02851
4.716671
other
Be2Zn1
3
69
31.86
mp-1096924
0.686327
3.092335
1.540146
other
Cr18N36
54
69
1,359.31
mp-1220481
-5.619619
-2.524723
3.590158
other
Nb4Al1
5
69
89.38
mp-1219810
-5.784129
-4.806952
3.95225
other
Pu4Zr1
5
69
92.75
mp-1220634
-6.055137
-2.065961
3.816636
other
Nb2Tc1
3
69
50.66
mp-2079
-3.450418
-4.248516
0.714253
other
Rb4P6
10
69
321.05
mp-1224230
-5.972538
-1.437156
4.001674
other
Hf1W2
3
69
53.01
mp-1216449
-6.477819
-0.917599
3.795765
other
V4Ru1
5
69
67.78
mp-1225520
-7.283545
-7.009183
6.524005
other
Er2Mg1
3
69
85.9
mp-15557
-4.670168
-5.287367
0.340373
other
Cs4As6
10
69
405.21
mp-1080356
-4.267287
-4.986059
-3.42055
other
Ce18Se36
54
69
5,126.5
mp-554064
11.029711
13.282031
-3.540973
other
V12O26
38
69
454.91
mp-1219219
-6.005302
-1.072577
4.167554
other
Si1Tc4
5
69
71.85
mp-1220401
-5.632212
-2.497109
3.495771
other
Nb4Pd1
5
69
87.75
mp-1223979
-6.235933
-6.002555
0.985994
other
In2Bi1
3
69
86.3
mp-1217156
-5.645964
-2.984816
3.916471
other
Ti4Cr1
5
69
79.94
mp-1220677
-6.082699
-2.172413
3.736113
other
Nb2Ru1
3
69
50.72
mp-1217161
-5.597806
-2.815993
3.897815
other
Ti4Fe1
5
69
79.3
mp-600604
6.997446
9.935097
-1.691258
other
Cu1O2
3
69
83.76
mp-14652
-3.551388
-4.294119
0.732132
other
Cs4P6
10
69
362.5
mp-569678
-7.756063
-4.146858
2.906082
other
Rh8Pb10
18
69
382.94
mp-1221635
-7.461377
0.304284
4.054111
other
Mn1Fe4
5
69
56.39
mp-1219490
-5.787954
-0.414518
3.544136
other
Re1W2
3
69
47.67
mp-1224941
-6.368151
-0.42942
3.458401
other
Fe1Mo2
3
69
43.66
mp-1220678
-5.74579
-2.512802
3.502285
other
Nb2Pd1
3
69
51
mp-15556
-4.625017
-5.176759
0.275343
other
Rb4As6
10
69
357.21
mp-1219494
-5.862308
-0.499195
3.547364
other
Re1W4
5
69
79.8
mp-1224889
-7.510876
0.073768
3.747884
other
Ga1Fe4
5
69
60.87
mp-1224345
-5.758587
-1.503865
3.867648
other
Hf1Mo2
3
69
52.79
mp-1216276
-7.248621
-1.251243
4.133225
other
V1Ru4
5
69
70.69
mp-1216329
-7.289871
0.370604
4.008467
other
V1Fe4
5
69
59.28
mp-634105
2.039804
2.237298
-3.793853
other
H1Br1
2
69
57.63
mp-1224449
-5.82928
-1.118211
3.614265
other
Hf1Mo4
5
69
84.12
mp-1220441
-5.73093
-2.364824
3.534768
other
Nb4Rh1
5
69
87.3
mp-556591
15.582355
5.678428
0.365565
other
Si18O36
54
69
1,073.18
mp-1228952
-7.344501
0.30972
4.180598
other
Al1Fe4
5
69
59.77
mp-1215231
-5.81152
-1.544773
3.864138
other
Zr1Mo2
3
69
53.45
mp-1228006
-6.130696
-1.153422
4.001856
other
Al1V2
3
69
41.49
mp-1226757
-7.34898
-7.618708
1.766161
other
Cd1Hg2
3
69
82.29
mp-1226243
-6.740243
-0.645839
3.85353
other
Cr4Ni1
5
69
57.04
mp-1221461
-6.111236
-0.68828
3.496557
other
Mo4Ru1
5
69
77.74