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-1238367
9.830931
3.719965
-4.12987
other
Mn4H32Cl8O16
60
14
770.21
mp-1200630
13.531155
4.374862
-2.69749
other
B32H16Pb4O60
112
14
1,166.49
mp-1196323
7.877558
4.586832
-6.127001
other
K12Sn4C28O64
108
14
1,619.57
mp-1195349
11.683108
7.258609
-5.882434
other
Cu24Ag16P16O72
128
14
1,641.82
mp-758097
8.167306
1.961371
-4.30793
other
H24C8N16O4
52
14
494.31
mp-1203799
9.57766
4.954372
-6.445575
other
Ti4Pb4S24O84
116
14
1,721.41
mp-1208858
5.910358
8.485204
-0.05235
other
Sr4Dy2Bi2O12
20
14
307.51
mp-728690
13.61814
6.026467
-0.692785
other
Si32B4N4O72
112
14
1,988.55
mp-1047929
8.917831
2.010271
1.488274
other
Ba4Ca4Mo4F28
40
14
649.53
mp-1201376
9.373818
7.143484
-3.496509
other
Zn2In4Se8O24
38
14
618.86
mp-1273600
11.312784
12.089947
-1.202082
other
Mg4Mn2W2O12
20
14
223.55
mp-554854
13.575299
5.312922
-6.565213
other
Cs4Lu4P8O28
44
14
731.03
mp-24475
9.324555
3.565964
-5.032347
other
Ni4H24C8O24
60
14
571.58
mp-690702
13.829007
7.022574
-5.554642
other
Sn4P4H4O16
28
14
374.73
mp-540611
13.116194
5.985545
-6.635324
other
Rb4Nd4P16O48
72
14
1,044.22
mp-1370620
11.229267
10.626885
-0.186702
other
Ca4Te2W2O12
20
14
280.95
mp-1047787
11.144804
7.86661
-4.441858
other
Zn6Co6As8O32
52
14
667.31
mp-765626
10.220703
12.598507
-4.424884
other
Li4V4O8F8
24
14
269.06
mp-1205033
8.1385
2.0586
-0.583031
other
Sb12Au4Xe8F72
96
14
1,959.83
mp-562172
6.258957
5.091438
-4.595547
other
Co4Ag4N12O36
56
14
687.99
mp-758472
8.01786
4.299817
-7.480954
other
Li4Mn4C4O16
28
14
295.13
mp-1210603
13.078217
5.657468
-6.424208
other
Mg2Zn4P4O16
26
14
330.2
mp-23749
10.194942
3.05706
-3.915567
other
V2H24Cl6O12
44
14
499
mp-1211079
13.03108
5.267259
-0.644971
other
Li4Tb24B12O56
96
14
1,182.11
mp-1198559
10.699953
4.082417
-4.39696
other
Fe4H56S4O44
108
14
996.56
mp-740765
8.303936
1.288595
-3.957358
other
Na4Ga4H32N16
56
14
837.18
mp-768736
13.70308
4.718513
-2.306649
other
Li4Bi4B8O20
36
14
443.73
mp-26619
14.467344
8.246021
-6.926883
other
Li12V4P8O32
56
14
567.17
mp-771018
12.870118
6.040317
-3.001416
other
Li8Mn4B4O16
32
14
360.15
mp-1200442
11.684155
4.567719
-4.937725
other
Mg2P4H16O20
42
14
392.52
mp-1211327
7.865339
7.037766
-3.933415
other
Na4Ce4Se8O40
56
14
818.66
mp-1213314
10.974584
6.397562
-5.232491
other
Cu10As4H8O24
46
14
483.02
mp-540038
12.685277
8.590094
-6.336896
other
Li4Mo4P8O32
48
14
671.07
mp-24164
9.292135
6.833329
-3.742588
other
Cu2H4Se4O12
22
14
282.08
mp-736390
8.776715
3.492003
-5.85575
other
Sr4H12C12O28
56
14
629.52
mp-26369
12.591698
7.268472
-7.544679
other
Li16Ni4P8O32
60
14
677.27
mp-1198141
8.533579
1.837995
0.147455
other
Ta4Cd4B4F40
52
14
735.4
mp-12323
7.554924
10.397309
1.092098
other
Na2Sm4Ir2O12
20
14
260.75
mp-723483
8.865003
4.469253
-4.103102
other
Sr4Zn2H12O12
30
14
416.88
mp-706982
9.788181
2.333211
-4.39375
other
H40S4N8O16
68
14
642.73
mp-866646
-3.669464
-1.597919
-5.404717
other
K4Ge4Bi4S16
28
14
751.56
mp-1201786
13.193474
4.659858
-2.412121
other
K4B12Se4O28
48
14
729.88
mp-1214121
8.579622
11.465171
1.898848
other
Ca8Nb4Fe4O24
40
14
483.83
mp-573037
7.662173
11.764281
1.77708
other
Tb4Mn2Ni2O12
20
14
225.46
mp-1179616
13.169253
7.419984
-5.380249
other
Sb8P8C8O28
52
14
953.37
mp-770290
14.635738
5.773559
-2.236001
other
Li12B8Sb4O24
48
14
523.83
mp-1179703
9.513336
3.437665
-4.531483
other
V8H60N12O48
128
14
1,198.85
mp-734031
6.258647
5.185739
-4.484361
other
Cs4Dy4N16O60
84
14
1,444.04
mp-6089
13.148133
5.537684
-6.285151
other
Ba4Zn8P8O32
52
14
800.71
mp-1019542
13.533352
4.537665
-1.570242
other
Ba8Ca8B16O40
72
14
1,024.76
mp-860958
14.364247
7.672533
-6.961245
other
Li8Mn8P8O32
56
14
620.39
mp-1043686
9.844732
9.187628
-0.368987
other
Ca4Bi4Sb4O20
32
14
585.82
mp-759440
10.637074
2.601172
0.732478
other
Li4V4O4F12
24
14
362.02
mp-1212130
6.291114
4.973331
-4.641588
other
Li12Tb4N24O72
112
14
1,484.98
mp-758460
13.708361
8.474615
-5.848233
other
Li4P8W4O32
48
14
675.37
mp-568379
-4.66963
-2.964526
-3.872836
other
K8In8Sn8Se32
56
14
1,945.87
mp-778460
13.067924
6.633119
-6.443754
other
Li24Bi8P16O64
112
14
1,281.73
mp-26519
14.722067
8.259509
-5.469187
other
Li12Mo4P8O32
56
14
585.23
mp-1198968
12.716573
5.830754
-6.11743
other
Be8P8Pb4O32
52
14
633.91
mp-759218
11.07477
8.848742
-7.398983
other
Na4V4P8O32
48
14
648.27
mp-24384
10.109669
3.04718
-3.90604
other
Ca2H16Cl4O8
30
14
398.85
mp-1197327
11.30288
6.530197
-6.793549
other
Sc4P8N4O32
48
14
788.31
mp-558666
9.488847
1.912274
-0.060849
other
K4V4O4F16
28
14
446.76
mp-23755
8.776305
3.503579
-5.926457
other
Ba4H12C12O28
56
14
707.38
mp-756053
13.513478
5.525674
-2.951229
other
Li4Co4B4O12
24
14
272.52
mp-572794
2.998035
3.108281
-4.544973
other
Re4P4Cl24O12
44
14
1,190.35
mp-1227146
11.875864
10.357485
3.280195
other
Ca4Nb4N4O8
20
14
253.55
mp-705159
11.187835
10.900245
-3.592331
other
K16Co16Mo24O96
152
14
2,311.41
mp-1199950
7.733263
7.522327
-4.307589
other
Na4Ni2P8O40
54
14
833.53
mp-1213309
8.801229
5.863268
-6.312956
other
Er4Tl4S8O36
52
14
778.84
mp-1202707
6.586901
0.260769
-3.374869
other
B40H40C8I8
96
14
1,577.09
mp-1214960
10.224109
5.041586
-4.546555
other
Al2H10Se4O16
32
14
356.52
mp-23082
7.767253
9.59584
-3.777062
other
K4Cr4Cl4O12
24
14
493.59
mp-18794
10.880627
10.343924
2.642561
other
Sm4Ti2Mn2O12
20
14
249.66
mp-1204811
9.78101
7.545016
-5.90014
other
In4P8Pb4O32
48
14
689.11
mp-1211965
11.303287
11.147274
-3.568433
other
K12Li12Mo12O48
84
14
1,486.74
mp-554599
9.842293
4.601777
-6.531964
other
Sn4S8O24F8
44
14
707.99
mp-554686
8.155463
2.065042
-0.844535
other
Mg4As8Xe8F72
92
14
1,563.5
mp-1203609
4.371338
2.901469
-3.978946
other
Fe4S16N16Cl16
52
14
1,341.97
mp-857348
14.335983
7.567082
-7.005932
other
Li8Mn8P8O32
56
14
648.27
mp-572487
10.111483
12.100497
-3.958068
other
Cs4U4V12O44
64
14
1,009.49
mp-759077
11.195306
8.080854
-7.943362
other
Li4Mn4P8O28
44
14
527.51
mp-22821
12.501013
6.431208
-6.412405
other
Sn4P8Pb4O32
48
14
664.7
mp-556695
13.284179
4.680445
-1.665908
other
Na4Sr4B4O12
24
14
303.67
mp-26086
13.694057
8.837942
-5.601202
other
Li4Mo8P12O48
72
14
948.18
mp-557231
10.215498
9.231175
-1.889994
other
K12Te12O24F12
60
14
1,169.84
mp-669471
4.197748
2.918246
-3.941537
other
Hg4S16N12Cl12
44
14
1,083.9
mp-568943
4.613357
2.530823
-3.533261
other
K4C4Se4N4
16
14
422.5
mp-1228210
9.603776
9.291521
1.153505
other
Ca8Ga6Fe2O20
36
14
456.89
mp-16209
-2.528885
-0.587459
-5.312069
other
K12La4P8S32
56
14
1,568.36
mp-1101517
10.100613
7.722786
-6.467127
other
Li4Ni4P20O60
88
14
1,236.97
mp-1197059
8.605088
1.224267
-3.957963
other
Li4Sn4H24N12
44
14
620.31
mp-18469
13.338763
5.509454
-6.572649
other
Sr4Mg4P8O28
44
14
583.32
mp-775915
13.734207
7.260561
-7.00805
other
Li4Mn4P12O36
56
14
777.65
mp-1195131
7.204627
10.78501
0.701199
other
Sr12Ca4Ir8O36
60
14
817.54
mp-562137
8.553546
3.648838
-7.22171
other
K4Li4C4O12
24
14
325.68
mp-770400
7.303365
11.721195
-1.394235
other
Li8Al4Ni4O16
32
14
348.48
mp-1195343
10.633739
10.9918
-3.760707
other
Pu4Mo4Br4O20
32
14
621.97
mp-1044359
11.738901
10.733078
-1.435815
other
Zn4Bi4W4O20
32
14
505.12
mp-504588
9.215387
3.893897
-5.91555
other
Cu8H8C4O20
40
14
387.86