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-504852
9.192918
8.628937
0.134838
other
Cs8Na12In4O16
40
14
786.53
mp-721182
9.748358
2.128995
-4.256264
other
P4H44N8O16
72
14
665.67
mp-1219791
10.983533
9.141504
3.680926
other
Pr4Zr4N4O8
20
14
284.78
mp-759441
13.958763
7.157953
-5.881192
other
Li8Cu8P16O48
80
14
1,038.15
mp-780694
13.555286
7.169086
-7.051553
other
Li8Mn4P16O48
76
14
1,029.11
mp-1196885
11.89666
8.719096
-2.939879
other
Nd4B4Mo4O24
36
14
462
mp-863395
12.51158
7.717092
-7.493089
other
Li12Co12P12O48
84
14
955.94
mp-1188494
6.895445
10.206658
0.371888
other
Eu4Mg2Ir2O12
20
14
239.44
mp-1042603
8.305635
11.083426
-3.149172
other
Ca8Cr16Co8O56
88
14
1,115.42
mp-1204395
11.065112
4.018547
-4.342998
other
Na12P8H76O64
160
14
1,545.08
mp-555091
8.187706
9.727137
-0.164413
other
Rb8Na8Ir4O16
36
14
606.09
mp-18774
11.578974
7.522332
-7.509292
other
Na4Fe4P8O28
44
14
537.47
mp-1213764
7.657771
7.641241
-4.205721
other
Cs8Te4S4O40
56
14
1,169.66
mp-562965
13.222146
6.94047
-6.996185
other
Cs4Cr4P8O28
44
14
640.66
mp-1180294
8.034138
6.567039
-5.244008
other
Na4Cu2S4O20
30
14
400.46
mp-1196747
12.13897
5.265184
-2.598751
other
Pu4B28I4O56
92
14
1,371.27
mp-556573
7.916139
4.697678
-5.19874
other
K8W4C8O36
56
14
906.91
mp-1201989
11.522131
4.919076
-5.561246
other
V8P24H48O48
128
14
1,640.03
mp-727215
8.538375
1.386578
0.747021
other
Al4Pb12O4F36
56
14
889.7
mp-1223342
8.676608
11.313284
2.140362
other
La4Mn2Cr2O12
20
14
248.86
mp-557213
8.152061
2.23381
-1.153668
other
Te8Xe4O8F40
60
14
1,102.55
mp-768429
13.071699
5.252479
-3.03668
other
Li8Mn8B16O40
72
14
722.81
mp-560517
2.252129
2.703054
-4.340335
other
Ti4S4Cl24O4
36
14
1,057.92
mp-26501
14.6991
8.208563
-5.653794
other
Li6Mo2P4O16
28
14
295.45
mp-1202171
11.144601
8.307876
-3.396559
other
Te4As4H4O20
32
14
440.6
mp-1204720
11.943851
5.437663
-2.722681
other
Pr4B28I4O60
96
14
1,419.42
mp-1197611
-3.220875
-1.801817
-5.549913
other
Ba8In4Ag4S16
32
14
888.97
mp-762355
14.55997
7.867703
-4.938092
other
Li4Ti4P8O28
44
14
529.79
mp-1223138
10.638411
10.287568
2.716377
other
La8Ti4Mn4O24
40
14
521.58
mp-1194283
10.916258
4.135111
-3.902824
other
Sr4Cu2H12O12
30
14
296.58
mp-1181469
3.526742
2.605661
-3.627284
other
Hg4C8Br16N8
36
14
1,804.28
mp-1047908
9.437907
1.872562
1.424173
other
Ba4V4Zn4F28
40
14
555.27
mp-1199996
11.696915
3.958569
-3.494702
other
Na4B28H72O80
184
14
2,085.73
mp-540621
11.756217
7.334221
-0.505883
other
Sr4Ga8Ge8O32
52
14
794.29
mp-1338518
5.600585
11.945197
-1.910471
other
Ca8Fe16Co8O56
88
14
1,038.33
mp-1180130
10.987082
6.246062
-6.943369
other
Na4Zr4P8O36
52
14
794.46
mp-729188
8.185144
1.059889
-4.214373
other
Sb16H80C24F48
168
14
2,311.07
mp-756998
10.14373
4.655249
-6.020817
other
Cd4H8S8O32
52
14
648.84
mp-861176
12.602807
7.600962
-7.767459
other
Li16Fe8P8O40
72
14
766.98
mp-558144
9.590098
3.274318
-4.729925
other
Cu4H40C8O32
84
14
829.44
mp-7012
8.093303
0.768875
1.719426
other
K2Rb4Y2F12
20
14
416.17
mp-1195614
-2.372784
-0.533064
-5.298749
other
La4Tl4P8S24
40
14
1,002.18
mp-1338782
7.594766
10.920368
-1.333565
other
Mg8Ti16Co8O56
88
14
1,127.84
mp-1179721
12.109341
4.874319
-5.187446
other
Rb8P8H16O32
64
14
842.74
mp-554083
11.478937
7.295395
-3.97312
other
Ba4Zn4As8O28
44
14
679.02
mp-1043010
11.468081
7.661372
-1.369932
other
Zn4Cu4Ge8O24
40
14
487.6
mp-1195296
10.037383
4.719455
-6.767571
other
K4Sb4S8O32
48
14
732.42
mp-759586
6.819154
11.832715
-1.395497
other
Na8Li8Co4O16
36
14
435.69
mp-605503
12.658566
6.740522
-6.520983
other
Cr4P12H8O40
64
14
769.21
mp-720267
10.482169
4.136392
-4.075987
other
Ba4B8H40O36
88
14
1,058.89
mp-972216
9.387372
9.074185
2.262605
other
Sr4Sm2Sb2O12
20
14
297.12
mp-1238424
9.632549
3.418731
-4.026892
other
Co4H32Cl8O16
60
14
842.09
mp-1223189
9.208234
10.341154
2.762275
other
La4Ti2Cu2O12
20
14
251.99
mp-761187
12.00603
7.394742
-7.17169
other
Li8Cu10P12O44
74
14
855.92
mp-12448
8.583211
10.523884
1.820948
other
Li2Sm4Os2O12
20
14
244.31
mp-1198186
6.200076
5.155456
-4.285965
other
Np2Co2N12O16
32
14
568.19
mp-1203919
4.367617
2.779702
-3.628129
other
Co4C16N8Cl16
44
14
1,403.75
mp-510642
11.707026
7.705539
-6.937803
other
Cu2Ni4P4O16
26
14
293.28
mp-680371
-2.431881
-0.569577
-5.117541
other
Rb4Pu4P8S28
44
14
1,127.87
mp-554223
11.744994
7.204956
-3.951162
other
Rb4Sc4As8O28
44
14
737.64
mp-554700
11.222983
11.654286
-3.599118
other
V8Zn12Te4O40
64
14
919.25
mp-1214191
7.234531
11.721935
1.48378
other
Ca12Mn4Cu4O24
44
14
532.16
mp-1197132
6.253172
5.04412
-4.496465
other
K4Pd2N8O24
38
14
580.94
mp-1193501
10.337214
4.30708
-7.111629
other
Li4Fe2S4O16
26
14
321.6
mp-1198510
11.238291
3.748329
-4.657358
other
P8H36N4O32
80
14
725.16
mp-1212036
7.624093
5.240955
-5.587245
other
K4Mo4C8O30
46
14
737.11
mp-1201671
11.281474
6.977815
-2.51634
other
Ge24C16N4O52
96
14
1,600.11
mp-1218605
6.407036
11.079781
0.657397
other
Sr4La8Fe12O36
60
14
737.07
mp-1200061
7.720484
0.489064
-3.930674
other
Li4B24H84N20
132
14
1,430.43
mp-696842
9.6981
6.062791
-3.916597
other
Na2H6Se4O12
24
14
293.21
mp-15519
13.877024
4.285626
-2.243858
other
Nd4Zn4B20O40
68
14
643.26
mp-861058
14.359908
7.376753
-7.036664
other
Li8Mn8P8O32
56
14
717.92
mp-779366
13.239911
7.486521
-7.164138
other
Li4Cr4P16O48
72
14
872.57
mp-1019730
13.491941
4.544391
-2.443388
other
Eu4Zn4B20O40
68
14
640.37
mp-1048269
14.415244
7.537
-6.130946
other
Mg4Fe4P8O28
44
14
511.14
mp-1048278
12.44289
7.303778
-7.000052
other
Zn4Ni4P8O28
44
14
492.62
mp-1210593
7.814821
7.402064
-4.40238
other
Na4V2S4O24
34
14
496.39
mp-697267
12.120577
4.965745
-5.160798
other
Tl8P8H16O32
64
14
876.66
mp-1201234
9.878052
4.28639
-4.774335
other
Cu4H32S12O40
88
14
1,040.48
mp-14316
9.087918
6.757366
-3.918101
other
K4Pr4Se8O32
48
14
761.1
mp-24397
10.621978
4.070101
-4.596461
other
Mg4H32S4O32
72
14
650.57
mp-1104988
-4.314025
-3.124209
-4.046359
other
Ba4Bi4Se6O4
18
14
501.88
mp-757461
11.042603
7.991792
-2.839599
other
Li16Cr8Si8O40
72
14
722.74
mp-1198190
8.516697
2.100164
-0.797279
other
Sr4Al4O8F16
32
14
494.43
mp-552051
9.589697
9.872643
-0.67084
other
Ca8Co4Te4O24
40
14
486.82
mp-1048126
14.003773
8.677755
-2.707021
other
Ca2P8W6O28
44
14
590.15
mp-1220568
6.587147
11.400509
0.897723
other
Nd4Co2Ni2O12
20
14
234.44
mp-1211123
8.566485
5.464839
-6.037434
other
Mn2Cu4S4O16
26
14
359.51
mp-759815
8.685606
3.553763
-7.600093
other
Li8Fe4C8O24
44
14
580.47
mp-770832
12.959503
5.801097
-3.464945
other
Li8B4Se4O16
32
14
407.59
mp-757041
15.016893
8.490763
-5.332236
other
Li16V8P8O40
72
14
755.6
mp-1201201
9.028792
6.67912
-3.955921
other
Cs12B4Se12O48
76
14
1,427.01
mp-1202013
8.12059
7.055787
-4.856759
other
K12Na4P8O44
68
14
1,187.74
mp-556790
11.066845
11.512438
-3.551365
other
Ba4V8Te4O32
48
14
763.04
mp-1203662
7.749155
6.118112
-5.030767
other
Fe4H8C8O24
44
14
564.35
mp-779057
13.052018
5.697982
-2.964847
other
Li8Fe8B8O28
52
14
506.15
mp-1201424
10.240189
9.420246
-2.128418
other
Fe4Te12Br4O28
48
14
881.81
mp-729448
8.133173
6.6008
-4.597774
other
K8S4I4O28
44
14
779.78
mp-1044350
11.768438
10.757301
-2.108077
other
Ca4Bi4Mo4O20
32
14
578.44
mp-1196488
10.09534
2.992688
-3.862965
other
Zn8H40Cl16O20
84
14
1,125.41