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-768771
13.82166
5.069797
-2.389276
other
Li12Bi4B8O24
48
14
532.02
mp-6219
4.251854
2.325223
-3.274436
other
K6Co2C12N12
32
14
603.35
mp-559100
10.611876
9.64973
-2.409
other
In8Te8Mo4O40
60
14
872.56
mp-557980
5.059923
2.771579
-3.911952
other
Cu4S16Br4N16
40
14
799.84
mp-24109
12.142128
4.874069
-5.246316
other
Na8P8H16O32
64
14
647.17
mp-720741
8.930634
4.563927
-3.936774
other
Ti2H28O12F12
54
14
626.32
mp-17234
14.430676
7.548331
-5.077184
other
K4Ti4P8O28
44
14
624.33
mp-783909
13.449947
7.588383
-0.763505
other
Li8Mn4Si4O16
32
14
360.48
mp-761059
14.578862
8.292145
-6.383934
other
Na12V8P12O48
80
14
1,015.37
mp-760212
11.651834
12.417473
-2.889944
other
Li12Ti8V12O48
80
14
1,028.96
mp-570593
-4.386556
-2.464401
-3.638895
other
Rb4Ag8As12Se24
48
14
1,351.75
mp-558502
10.017358
10.226011
-1.930843
other
Fe4Te4O12F4
24
14
331.45
mp-779757
9.755416
7.896764
-6.264791
other
Li4Ni16P24O84
128
14
1,602.54
mp-1042599
11.106245
11.951277
2.332173
other
Mg8Ta16Co8O56
88
14
1,224.39
mp-777353
13.621939
4.30525
-2.449955
other
Li12Mn4B32O60
108
14
1,265.37
mp-757386
14.862528
7.902294
-5.31419
other
Li8Cr8P8O32
56
14
684.17
mp-1197116
13.010534
4.357262
-2.749261
other
Ca8B20H28O52
108
14
963.68
mp-699658
9.990614
4.430426
-7.019049
other
Na32V8S24O104
168
14
2,219.77
mp-1020643
13.742007
4.209183
-2.194076
other
Rb12Zn4B20O40
76
14
1,161.19
mp-1202276
10.027849
3.804853
-4.585603
other
La4H24C4O28
60
14
722.85
mp-15003
12.466046
6.402937
-0.018806
other
Ca12Hf4Si8O36
60
14
777.33
mp-1213132
13.979145
4.286294
-2.192237
other
Er4Mg4B20O40
68
14
613.27
mp-1208928
8.392351
10.859225
1.643383
other
Sm4Co2Ru2O12
20
14
242.73
mp-707464
7.475618
4.489102
-4.675961
other
Cu4H12N12O24
52
14
578.1
mp-1199710
6.802707
0.54639
-3.486478
other
B40H48C12O8
108
14
1,215.02
mp-556890
9.327605
1.124569
1.048718
other
Ba4Na4Cr8F36
52
14
680.72
mp-706655
12.365511
4.145119
-3.108614
other
Na8B16H32O44
100
14
978.42
mp-1041448
11.790099
11.068625
-3.183578
other
Ca4Cu8Mo8O32
52
14
803.44
mp-548753
12.913874
9.020496
-7.056766
other
V4Co2P4O20
30
14
353.87
mp-764845
11.005482
2.559941
0.906011
other
Li4V4O4F12
24
14
274.37
mp-758923
8.254886
2.091737
-0.724948
other
Sb4As4Au4F36
48
14
828.03
mp-1207474
8.040139
2.564288
1.700911
other
Zr16N12O4F20
52
14
595.79
mp-14235
12.810784
6.353011
-0.498413
other
Sr4Ga8Si8O32
52
14
717.88
mp-757305
14.278763
7.24978
-5.794837
other
Li8Ti4P12O40
64
14
976.4
mp-1212710
8.0714
2.175859
-4.658928
other
H28C8N36O8
80
14
893.46
mp-19512
13.620114
8.71426
-6.747108
other
Ba4V8P8O40
60
14
820.57
mp-650049
4.854735
3.197004
-3.702749
other
Sb4C4N36Cl24
68
14
1,494.36
mp-557756
13.003896
6.561559
-6.896399
other
Li16Zn4P8O32
60
14
679.47
mp-707307
12.492824
5.244751
-5.361695
other
Nd8P12H20O40
80
14
975.73
mp-560506
14.507446
7.631951
-4.981705
other
Na4Ti4P8O28
44
14
563.81
mp-1196666
10.35831
3.230021
-4.030182
other
Mg2H48Cl4O24
78
14
850.78
mp-758100
11.964425
7.262771
-7.224717
other
Li4Cu4P4O16
28
14
330.27
mp-1209985
10.897729
9.211154
0.765968
other
Pr12V4Ge4O36
56
14
826.83
mp-1237285
6.472126
5.949367
-3.71366
other
Mg4Zn4Br16O28
52
14
1,015.89
mp-1306506
7.294771
11.200704
0.440301
other
Ca8Fe4Ir4O24
40
14
469.8
mp-26129
12.54806
6.502913
-6.342109
other
Li4Bi4P8O28
44
14
546.36
mp-542976
14.668011
7.725194
-5.239483
other
Sr4Fe8P8O32
52
14
667.7
mp-17959
11.96356
8.301802
1.549235
other
Nd8Si4Te4O16
32
14
551.33
mp-1197560
1.376906
2.370751
-4.985546
other
Ga32Sb28Te32Cl116
208
14
6,991.14
mp-863408
11.943536
7.06745
-1.19782
other
Li12Si12Bi12O48
84
14
1,122.22
mp-703305
12.713367
5.319228
-5.804074
other
Na8P4H4O16
32
14
378.87
mp-1204714
9.893365
10.099463
3.128653
other
Ca16Nb4Ga4O32
56
14
772.75
mp-558026
7.988142
2.42709
-1.136048
other
Sb4Se4I12F24
44
14
1,209.84
mp-11892
7.740541
10.48404
1.524868
other
Na2Nd4Ru2O12
20
14
266.32
mp-555010
7.589633
11.712697
1.875635
other
Sm4Mn2Ni2O12
20
14
232.26
mp-26123
12.201338
9.299244
-7.577898
other
Li4V8P12O48
72
14
879.87
mp-684489
12.55112
6.552209
-6.344463
other
Li4Bi4P8O28
44
14
606.75
mp-1203796
6.189719
5.179469
-4.494112
other
K4Ru4N16O32
56
14
863.61
mp-1201294
7.723673
6.76864
-4.834687
other
Cu4P4N4O20
32
14
514.54
mp-1207536
8.335966
2.628428
-1.254939
other
Zr2Cu2O8F12
24
14
351.1
mp-1043721
6.779782
8.958407
-0.961481
other
Mg4Sn4Bi4O20
32
14
489.27
mp-1214264
7.870658
5.972149
-5.343285
other
Cd2Cu4S4O16
26
14
392.64
mp-15362
13.661006
4.648248
-1.673792
other
Li12Nd8B12O36
68
14
720.05
mp-766099
13.799012
8.667807
-1.048008
other
Li8V8Si8O32
56
14
623.58
mp-1043740
12.688899
7.620621
-6.77914
other
Zn2Co6P8O28
44
14
488.13
mp-555913
11.538258
11.285461
-4.013525
other
Y4Mo4O16F4
28
14
408.35
mp-1179916
2.531411
3.009596
-4.553104
other
Pb12Cl16O8F4
40
14
960.55
mp-1201679
9.776097
10.630837
1.682141
other
Ba4La8W4O28
44
14
666.3
mp-1194747
12.755111
5.376859
-5.70139
other
Ca8P8H8O32
56
14
641.51
mp-25879
12.301874
7.510693
-7.087904
other
Li4Ni12P12O44
72
14
815.28
mp-18396
11.774317
7.353568
-7.488637
other
Rb4Fe4P8O28
44
14
627.08
mp-25857
14.306229
7.56143
-7.042745
other
Li8Mn10P12O44
74
14
916.12
mp-1202200
9.53671
7.847555
-4.038534
other
Sc4V4Se8O32
48
14
742.04
mp-1196719
6.859406
5.990207
-4.289404
other
Cu2S4N4O28
38
14
674.34
mp-601210
9.142296
2.842633
-4.946122
other
H20C8N4O16
48
14
461.07
mp-31979
13.50329
7.207186
-7.016004
other
Li4Mn2P8O24
38
14
530.82
mp-1208751
5.942445
8.511918
-0.033249
other
Sr4Tm2Bi2O12
20
14
301.48
mp-1201891
6.591381
5.96508
-4.038504
other
Cu2S4N4O28
38
14
643.68
mp-761773
13.550805
7.100323
-6.403916
other
Li4Sb4P16O48
72
14
974.93
mp-1203218
9.802721
8.064939
-0.380997
other
Rb36Al4H16O32
88
14
1,857.42
mp-1213728
6.29843
4.993421
-4.575849
other
Cs4U2N8O28
42
14
729.43
mp-1105276
10.142393
9.882935
3.162303
other
Gd4Ti2Zn2O12
20
14
239.31
mp-758944
12.751173
6.721246
-6.575511
other
Li4Bi4P16O48
72
14
985.52
mp-1301131
11.945019
11.806691
-0.960605
other
Mg4Cr2W2O12
20
14
211.93
mp-780872
11.366731
7.52344
-2.490659
other
Li8Mn8Si8O32
56
14
608.45
mp-1197015
11.664519
4.616347
-4.932268
other
Cd2P4H16O20
42
14
428.53
mp-560243
10.762229
4.148466
-4.511068
other
Np8H48S4O56
116
14
1,255.22
mp-863424
12.561269
7.237803
-7.170013
other
Li4Ni2P8O24
38
14
500.34
mp-765634
14.890893
7.871932
-5.641228
other
Li8Fe8P8O32
56
14
607.55
mp-1195890
11.033611
12.157372
-3.399171
other
Ba12Mn4V16O56
88
14
1,418.01
mp-25991
12.230099
7.477563
-7.345396
other
Li4Ni6P8O28
46
14
508.62
mp-759117
13.454693
6.894224
-6.331267
other
Li8Sb4P12O40
64
14
997.39
mp-12160
13.852722
4.78191
-2.103154
other
Li24Ho4B12O36
76
14
773
mp-1203568
-2.476545
-0.288781
-5.06697
other
Ti4P8S32Cl8
52
14
1,508.77
mp-1208325
12.784215
7.006049
-6.662955
other
Tl4Cu4P12O36
56
14
814.97
mp-1200796
13.394054
5.419786
-6.621651
other
Ba6In4P8O32
50
14
748.77
mp-759278
12.583997
7.236155
-7.087478
other
Li8Cu4P16O48
76
14
1,007.88
mp-1047501
13.880414
7.060766
-5.419303
other
Zn2Sn6P8O28
44
14
655.83
mp-1198967
3.84502
3.025511
-3.880973
other
Au4C4N12Cl16
36
14
989.16
mp-754427
11.48801
0.504991
0.685422
other
Li2Fe6O4F12
24
14
272.37