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-759825
7.851509
2.569874
0.905635
other
Bi4O4F4
12
62
194.09
mp-21347
-6.111905
0.455983
3.370745
other
Co4B4Mo4
12
62
120.87
mp-1208118
-7.399278
-5.992125
4.398983
other
Tm4Ni4Pb4
12
62
251.13
mp-554944
11.955417
3.899427
-8.361368
other
Ti4S4O20
28
62
383.7
mp-1006371
-2.996052
-3.179381
-3.135601
other
Ce8P8S8
24
62
536.63
mp-8130
11.26941
8.030874
0.114671
other
Ca4Ge4O12
20
62
216.43
mp-605437
10.384011
6.382247
-3.889385
other
Fe4H4O8
16
62
139.07
mp-1102621
-5.362593
-3.201893
6.021492
other
Er4Co4Si4
12
62
191.79
mp-28881
1.393906
2.201553
-5.238763
other
Rb8U4Cl20
32
62
976.99
mp-17054
-3.641697
-1.356687
-5.157119
other
Cs12Ta4S16
32
62
1,183.55
mp-1095664
-6.592652
-0.422646
2.075887
other
Fe4Co4P4
12
62
131.45
mp-641635
6.752065
6.370832
-3.77107
other
Ca4C4O12
20
62
306.46
mp-1102207
-8.316729
-4.458974
5.356666
other
Er4Ga4Ni4
12
62
206
mp-1103487
-7.952641
-4.444023
3.891251
other
Ce4Ga4Pt4
12
62
248.92
mp-1245425
-2.380575
1.218403
2.455238
other
Fe16Se12N8
36
62
491.58
mp-672344
-7.989074
-3.978348
3.737963
other
Ce4Al20Pt12
36
62
632.6
mp-1103243
-6.117098
-2.052266
2.171328
other
Nb4Ni4As4
12
62
170.81
mp-1199363
10.343176
8.600681
2.170907
other
Ba12Al4O16
32
62
637.04
mp-1212133
-5.073801
-3.794228
5.83356
other
Ho4Si4Ni4
12
62
199.55
mp-752453
10.25813
9.728564
3.258799
other
Sm8Ti4O20
32
62
448.4
mp-607126
-8.532333
-6.245962
2.992211
other
Nd4In16Au8
28
62
672.41
mp-1207955
-8.58232
-4.54003
5.428351
other
Tm4Zn4Rh4
12
62
216.45
mp-1193175
8.535551
11.677102
0.317086
other
Na4Ru8O16
28
62
291.36
mp-1213445
1.119721
1.898148
-5.393534
other
Cs4Er8Cl28
40
62
1,178.82
mp-1246011
-8.715828
1.597741
-3.49919
other
Te12W16N8
36
62
683.48
mp-1232097
-2.679252
-2.678942
-5.75903
other
Tb8Mg4S16
28
62
707.46
mp-22162
-7.732252
-4.783905
3.399658
other
Yb4Ni4Sn4
12
62
243.31
mp-1192634
-5.779291
-3.874734
-1.644108
other
Ba4Lu8Te16
28
62
968
mp-1209158
8.256745
4.556402
-5.542616
other
Rb4S4O8
16
62
394.07
mp-1212729
7.034616
8.899303
-0.397923
other
Eu4Ga4O12
20
62
236.16
mp-779858
10.279964
9.443903
3.274596
other
Sm12Nb4O28
44
62
636.1
mp-1029605
1.047181
2.360205
1.4539
other
Na8Mn4N8
20
62
301.62
mp-1245804
0.980789
2.370067
1.743944
other
K4Mn4N4
12
62
244.97
mp-22579
9.054321
6.662199
-4.315521
other
Mn4Se4O16
24
62
321.68
mp-1186835
3.217677
-0.514194
-2.547467
other
Rb8Mg4H16
28
62
758.48
mp-770870
7.742082
13.494915
-1.095713
other
Mn4Tl4O12
20
62
240.13
mp-14207
-5.339973
-5.743614
0.67589
other
Ba4Zn8Sb8
20
62
560.89
mp-22649
11.809942
12.985105
-1.859911
other
V4Cd4O12
20
62
218.64
mp-1208842
-5.777237
-3.837032
-1.276148
other
Sm4Te4As4
12
62
319.04
mp-1199697
-8.000495
-4.250189
3.894555
other
Ce12Al24Pt16
52
62
1,047.55
mp-770379
11.60695
7.606447
0.833982
other
Tm8Ge4O20
32
62
399.75
mp-21191
-5.692147
-3.42383
4.799269
other
U4Si4Pd4
12
62
222.35
mp-778697
10.553168
1.01038
1.625232
other
Li8Mn8F24
40
62
441.18
mp-1192582
-4.764661
-3.071017
-3.92506
other
Mg8Si4Se16
28
62
656.3
mp-1188587
-3.114687
0.518491
2.661979
other
Er4W4C8
16
62
203.53
mp-1203341
-3.392732
-1.542188
-4.360616
other
V4S16N12
32
62
1,032.43
mp-755167
7.580929
13.537131
-1.440186
other
In4Co4O12
20
62
202.45
mp-541998
-4.962013
-2.693034
-3.684922
other
K12Fe8Se16
36
62
1,028.85
mp-644828
8.329144
2.261834
-0.74391
other
Au4Xe8F68
80
62
1,334.15
mp-1102652
-4.093388
-5.536301
5.225462
other
Eu4Mg4Si4
12
62
286.45
mp-558611
8.553346
11.5648
-0.351678
other
Ba16Fe32O64
112
62
1,871.29
mp-864645
-6.754154
-3.898909
3.741905
other
Yb4Si4Pt8
16
62
280.64
mp-1101952
-5.629946
-2.585191
4.746696
other
Hf4Si4Ni4
12
62
172.5
mp-504692
10.229891
9.414084
-2.226669
other
Ni8Te16O40
64
62
944.9
mp-1190981
-3.302229
-1.923731
-5.586898
other
Sr8Zn4S12
24
62
577.47
mp-1189043
-0.532821
0.431698
-0.029995
other
Cs4K4C8
16
62
446.17
mp-20378
-8.314581
-6.461694
2.91783
other
Ca4In4Au4
12
62
287.85
mp-1245705
0.747356
2.381363
1.9178
other
Mg4Co4N4
12
62
144.89
mp-653559
-2.755978
-1.240676
-3.745417
other
P16Se12I8
36
62
1,142.08
mp-1105961
1.830519
1.819257
2.21675
other
Th4Ta4N12
20
62
262.86
mp-1190838
8.346036
1.066789
1.971795
other
Rb4La4F16
24
62
400.69
mp-638061
1.556962
2.368602
-5.294307
other
Al4In4Cl16
24
62
712.24
mp-1102700
-8.046702
-3.090052
4.725318
other
Tm4Ge4Ir4
12
62
216.51
mp-1193242
1.510309
2.797735
-6.10485
other
Cs8Co4Cl16
28
62
938.31
mp-17730
9.692665
8.694894
0.271699
other
K8Sn4O12
24
62
419.36
mp-21712
-6.167417
-3.331543
4.507356
other
Tb8Ti12Ge16
36
62
678.47
mp-1016154
11.588578
11.75269
0.280243
other
Mg4Mn4O8
16
62
170.81
mp-1343137
10.529777
12.370092
1.829422
other
Ti4Zn4O12
20
62
205.8
mp-1216921
-5.04365
-3.802908
-0.312504
other
U4Te4Se4
12
62
296.42
mp-504563
-5.174953
-2.492477
-3.394014
other
Ba4Fe8Se12
24
62
606.82
mp-20947
7.982184
11.003818
0.819144
other
Ca4Ru4O12
20
62
227.74
mp-510475
8.155029
10.082624
1.695413
other
Y8Cu8O20
36
62
506.85
mp-1209185
8.370279
1.201759
1.941315
other
Rb4Pr4F16
24
62
390.09
mp-5690
10.231281
8.480812
3.208797
other
Gd4Sc4O12
20
62
251.67
mp-624769
12.098286
8.495421
-5.970705
other
P8W4O32
44
62
563.15
mp-648157
5.673738
3.263654
-4.696857
other
Os24C76O80
180
62
3,053.62
mp-1101471
6.15929
9.898661
-1.904243
other
Rb8Fe4O16
28
62
508.55
mp-31117
10.215075
8.475613
3.228909
other
Nd4Sc4O12
20
62
260.34
mp-772047
13.468076
9.702248
-0.682638
other
V8Si4O16
28
62
310.54
mp-7756
-5.279338
-6.037353
0.726031
other
Sr4Li4Sb4
12
62
330.99
mp-1232081
-4.30344
-4.203794
-3.855631
other
Tm8Mg4Se16
28
62
717.48
mp-1378846
10.989179
9.458895
0.292917
other
Mg4Sn8O16
28
62
372.21
mp-1179112
7.596439
9.846814
-1.086837
other
Sr4Ru4O12
20
62
386.93
mp-777667
11.178679
12.862411
-3.503736
other
Li4V8O20
32
62
374.47
mp-754298
13.038559
12.411384
-0.552717
other
Mn4V8O16
28
62
298.24
mp-764345
13.042624
8.444867
-7.47262
other
Cr4P4O16
24
62
265.77
mp-505081
-4.822367
-1.950501
1.547783
other
Ti8Ni4P20
32
62
458.56
mp-1213261
1.07684
1.904924
-5.441826
other
Cs4Tb8Cl28
40
62
1,207.62
mp-569967
1.174779
1.94793
-5.488342
other
K8Pr4Cl20
32
62
898.57
mp-17544
7.262322
13.988314
-1.546784
other
Ca4Co8O16
28
62
261.4
mp-1326513
12.783644
10.664702
-0.224631
other
Mg4W4O12
20
62
227.33
mp-19866
-5.136512
-3.476947
-0.184561
other
U4Te4S4
12
62
298.64
mp-1192981
-8.256705
-6.261547
2.757767
other
Eu4In16Au8
28
62
672.33
mp-779096
10.479601
9.386607
3.287946
other
Tm12Ta4O28
44
62
577.89
mp-1102191
-9.052039
-6.07822
3.485291
other
Dy4Al4Au4
12
62
246.74
mp-4967
11.246675
4.023547
-7.573821
other
Mg4S4O16
24
62
270.85
mp-20799
-2.753202
0.482523
2.548261
other
Er8Re4C8
20
62
320.31
mp-1207608
-8.492933
-4.660972
5.457881
other
Y4Zn4Rh4
12
62
224.71
mp-19242
6.560081
11.48436
0.649326
other
Y4Ni4O12
20
62
210.05
mp-1199087
-3.36169
-3.825422
0.468725
other
Cd4Sn4P56
64
62
1,452.16