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-569491
-4.793326
-2.938599
-3.820908
other
Na4La4Ga16Se32
56
70
1,457.02
mp-1044012
9.20796
7.965542
-5.507185
other
Mg2Fe4P4O20
30
70
326.22
mp-15217
-3.566264
-1.097514
-5.283011
other
Rb4Ta2Ag2S8
16
70
505.37
mp-23994
11.778009
6.110979
-2.211547
other
U4Si2H8O20
34
70
442.05
mp-8972
-4.722206
-2.836973
-3.707572
other
K4Ta2Cu2Se8
16
70
487.43
mp-1188845
-4.619463
-2.995686
-3.811168
other
K4Ag4Ge2Se8
18
70
527.14
mp-11923
-3.583376
-1.144774
-5.376275
other
Rb4Ta2Cu2S8
16
70
472.47
mp-1210450
-3.398393
-1.978441
-4.198695
other
Rb8Ta4Cu4S8
24
70
805.29
mp-555116
6.708474
10.378456
-1.405099
other
K8Na4Mn4O16
32
70
527.29
mp-1203629
8.20681
1.210406
-4.418011
other
H40C12N12Cl4
68
70
733.78
mp-1214873
11.907214
6.875097
-5.13439
other
Cd4P8Pd2O16
30
70
697.63
mp-1210710
-3.996485
-2.587334
-3.681834
other
Rb8Ta4Cu4Se8
24
70
812.47
mp-8901
-3.587403
-0.843343
-5.325005
other
Rb4V2Ag2S8
16
70
476.96
mp-556509
10.867946
11.60787
2.270288
other
U2Ti2Nb4O20
28
70
397.96
mp-1044192
9.934104
8.182979
-6.717208
other
Ca2Mn4P4O20
30
70
344.86
mp-1044011
9.243665
8.094852
-6.196976
other
Mg2Co4P4O20
30
70
317.66
mp-15221
-3.491281
-1.124449
-5.448952
other
Rb4Nb2Cu2S8
16
70
471.78
mp-15214
-3.477863
-1.021302
-5.294942
other
K4Nb2Ag2S8
16
70
465.9
mp-14636
-3.470118
-1.076818
-5.335906
other
Rb4Nb2Ag2S8
16
70
503.17
mp-1199865
-3.724344
-1.481647
-5.752842
other
Na4La4Ga16S32
56
70
1,296.52
mp-1019517
2.083466
1.958804
1.479719
other
Ba8Mg2Si4N12
26
70
471.76
mp-1212810
-4.417713
-3.128973
-3.384729
other
K8Nb4Cu4Se8
24
70
660.74
mp-1044104
11.317827
8.454252
-7.001881
other
Zn2Cr4P4O20
30
70
322.28
mp-623028
-3.498366
-1.138311
-5.263635
other
Cs4Nb2Ag2S8
16
70
547.81
mp-1192524
11.75577
7.264038
-3.91639
other
Na4Th2As4O16
26
70
412.27
mp-1212411
-4.371033
-2.681853
-3.712438
other
K8V4Ag4Se8
24
70
714.09
mp-14634
-4.937413
-2.588495
-3.509673
other
K4V2Ag2Se8
16
70
484.5
mp-1198591
11.200715
8.592937
-5.54516
other
Rb4Mo4P4O24
36
70
574.73
mp-1044073
11.443029
8.367245
-7.20896
other
Mg2Cr4P4O20
30
70
320.73
mp-8900
-3.64039
-0.8272
-5.271687
other
K4V2Ag2S8
16
70
421.49
mp-510338
-3.444333
-0.931825
-5.360206
other
Cs4Li2V2S8
16
70
514.44
mp-1212580
-3.601651
-1.922076
-4.072118
other
K8Nb4Cu4S8
24
70
608.78
mp-1044202
9.192404
7.920978
-5.318495
other
Ca2Fe4P4O20
30
70
340.04
mp-570876
-4.78914
-2.97278
-3.815998
other
Na4Nd4Ga16Se32
56
70
1,475.9
mp-1044114
9.187203
8.039186
-6.103899
other
Zn2Co4P4O20
30
70
318.69
mp-18527
11.259147
8.452988
-5.554288
other
Cs4Mo4P4O24
36
70
594.49
mp-1194675
10.381688
4.317124
-5.114067
other
Hf2H16S4O24
46
70
426.64
mp-1211022
-4.276844
-2.674024
-3.806569
other
Rb8V4Ag4Se8
24
70
1,044.37
mp-15219
-3.797263
-0.90851
-5.339605
other
Rb4V2Cu2S8
16
70
429.24
mp-646612
-4.757045
-2.960509
-3.762775
other
Na4Ce4Ga16Se32
56
70
1,485.33
mp-1196048
10.289839
4.275155
-5.130162
other
Ce2H16S4O24
46
70
482.34
mp-559729
6.335238
3.349893
-4.560564
other
K4Fe2C8O8
22
70
386.6
mp-16991
10.811073
9.219742
-4.266545
other
Rb4Mo4As4O24
36
70
618.8
mp-680171
-3.439939
-1.525066
-5.532351
other
K4Eu8Cu4S24
40
70
953.03
mp-1043971
9.110126
7.9449
-5.499353
other
Zn2Fe4P4O20
30
70
324.62
mp-560438
12.932526
6.208998
-0.836834
other
Na12Be6Si12O36
66
70
834.32
mp-1195284
5.525596
-0.409026
-3.051542
other
K2Al2B8H32
44
70
496.33
mp-17138
11.267248
8.699682
-5.578294
other
K4Mo4P4O24
36
70
562.15
mp-1212400
-4.473634
-2.9209
-3.670995
other
K8V4Cu4Se8
24
70
773.69
mp-558500
-3.677632
-1.483555
-5.530132
other
K4Ag4Ge2S8
18
70
466.37
mp-758734
11.440822
12.908284
0.037802
other
Li4Cr4Si2O12
22
70
207.88
mp-14635
-4.915684
-2.56604
-3.518129
other
Rb4V2Ag2Se8
16
70
525.34
mp-1044185
9.140897
8.027461
-5.918796
other
Ca2Co4P4O20
30
70
337.42
mp-669330
-4.405071
-3.839741
-3.563279
other
K4Ce8Cu4Se24
40
70
1,062.72
mp-18480
9.940982
9.982409
3.021978
other
Na6Ca4Ta2O12
24
70
315.5
mp-1212584
-3.819232
-1.552297
-4.347555
other
K8V4Cu4S8
24
70
789.8
mp-9763
-3.499709
-1.133697
-5.458254
other
K4Nb2Cu2S8
16
70
437.92
mp-726643
8.309033
1.501682
-0.033015
other
K8Sn4O4F24
40
70
745.57
mp-1044099
8.803925
7.965212
-5.395107
other
Mg2Ni4P4O20
30
70
318.36
mp-11924
-4.728881
-2.827949
-3.635084
other
Rb4Ta2Cu2Se8
16
70
522.74
mp-1195238
-0.28374
2.353893
-3.49741
other
Cu8Pb16I24O16
64
70
2,024.24
mp-22235
-5.947222
-3.540714
-1.914968
other
Cs4Mn2Sn2Te8
16
70
701.66
mp-1043935
9.864733
8.2037
-6.733186
other
Mn4Zn2P4O20
30
70
332.68
mp-17542
11.452178
8.765569
-5.415163
other
Tl4Mo4P4O24
36
70
568.75
mp-1044068
9.998337
8.237117
-6.90385
other
Mg2Mn4P4O20
30
70
329.84
mp-1192405
11.777954
7.57027
-6.117499
other
Hg2P4Pd4O16
26
70
328.92
mp-1195759
12.365116
5.896443
-5.83647
other
Ag8P8H8O28
52
70
595.02
mp-581085
9.508287
0.520064
0.553644
other
Na14Sr4Fe14F64
96
70
1,324.69
mp-561641
-3.714485
-1.542937
-5.488927
other
Cs4Sn2Au4S8
18
70
598.16
mp-1044205
13.944777
8.882704
-4.777662
other
Ca2Mo4P4O20
30
70
373.54
mp-14515
-3.762858
-1.491735
-5.783517
other
Na4Nd4Ga16S32
56
70
1,282.71
mp-1044127
8.727052
7.939522
-5.425246
other
Zn2Ni4P4O20
30
70
316.39
mp-15222
-4.736276
-2.737618
-3.594718
other
Rb4Nb2Cu2Se8
16
70
521.27
mp-669377
1.273463
2.032242
1.359903
other
Ba8Ca4W4N16
32
70
599.49
mp-1214878
13.492965
7.700675
-0.898217
other
Ba4Be8B8O16
36
70
471.14
mp-15220
-4.975924
-2.683735
-3.551152
other
K4V2Cu2Se8
16
70
457.2
mp-1212401
-3.825422
-1.636317
-4.698278
other
K8V4Ag4S8
24
70
650.04
mp-558932
8.274516
2.021488
-0.767826
other
K4Ni4As12F72
92
62
1,428.97
mp-613785
7.995412
8.273972
-2.643799
other
Yb12Si8Cl4O32
56
62
794.16
mp-10234
2.165001
2.173368
1.232901
other
Sr8B4N8F4
24
62
402.86
mp-1196534
-6.613579
0.127969
3.456363
other
Mn20Fe8B4C8
40
62
358.49
mp-9360
14.129353
7.188926
-4.847283
other
Ca4U4P8O32
48
62
613.72
mp-1222016
12.358227
7.497375
-1.270029
other
Mg4Si4Ni4O16
28
62
295.25
mp-720859
8.709646
1.127359
-4.271136
other
V4H44N12Cl20
80
62
1,028.2
mp-1197888
1.248152
2.526894
-3.50896
other
In4Au4I32N8
48
62
2,078.39
mp-1204505
8.904602
7.765675
-2.721093
other
Na8In4Si4O20
36
62
418.42
mp-669361
11.058882
7.831175
-3.99462
other
Cu8Bi4As4O24
40
62
512.41
mp-1223394
10.703676
11.650725
2.981325
other
K4Ta4Ti4O20
32
62
470.58
mp-1200210
10.55367
10.733383
-4.214077
other
Ba4V8Se4O32
48
62
715.88
mp-556347
1.802588
2.73117
-5.073484
other
K8Re4Cl20O4
36
62
961.28
mp-1211867
1.375455
2.186927
-4.029327
other
K4Nb12V4Cl44
64
62
1,565.43
mp-18334
11.691699
7.31755
0.242829
other
Na4Ho4Ge4O16
28
62
396.21
mp-1181561
0.52625
1.66579
-4.223681
other
K16Bi8Br40O16
80
62
2,404.55
mp-559318
10.932839
11.06891
-2.51756
other
U4Ag8W8O40
60
62
862.14
mp-558773
11.46238
11.229162
-2.595215
other
La4W4Cl4O16
28
62
466.36
mp-1180720
5.706948
3.19435
-3.482887
other
Mn4C32N8Cl16
60
62
1,821.22
mp-1213821
1.45856
2.604425
-5.707931
other
Cs8Tl4H4Cl20
36
62
1,244.18
mp-23622
12.144142
6.730484
0.552647
other
Sm12Si8Cl4O32
56
62
812.64
mp-761681
9.205236
7.102417
-3.614656
other
Cr4H4Se12O32
52
62
795.71
mp-15904
9.311714
8.522405
2.704948
other
Ba4Gd8Zn4O20
36
62
529.95