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-1208962
8.477005
10.834315
1.517518
other
Sm4Ni2Ru2O12
20
14
241.99
mp-1200516
9.289596
7.242273
-3.5549
other
In4Cu6Se12O36
58
14
864.83
mp-694075
5.641647
4.789736
-4.1689
other
Fe8I8N16O16
48
14
1,272.54
mp-1238754
8.846956
3.676152
-6.649008
other
Cs4H4C4O12
24
14
382.77
mp-1198737
-2.967698
0.657081
-3.543375
other
Cs4Tc12Se16Br8
40
14
1,201.47
mp-758897
11.328357
7.491261
-7.236053
other
Li12Cu12P12O48
84
14
982.96
mp-758780
12.553814
6.477287
-6.371327
other
Li4Bi4P8O28
44
14
634.26
mp-757511
12.595934
7.319878
-7.118501
other
Li8Ni4P16O48
76
14
988.33
mp-774871
10.135049
12.342082
-3.600266
other
Li10V12Cu12O48
82
14
893.25
mp-1200124
11.526329
7.066548
-3.478256
other
P4Pb8I4O16
32
14
644.52
mp-559182
8.590255
2.175954
-0.839059
other
P16Ir8Cl8F48
80
14
1,474.84
mp-1225359
12.210999
6.106411
-3.415217
other
Fe4Cu8B4O20
36
14
365.52
mp-1047992
13.913784
7.005577
-5.571562
other
Zn4Sn4P8O28
44
14
589.77
mp-16605
9.963995
9.73435
3.651849
other
Sr4Tm2Ta2O12
20
14
283.74
mp-1211286
13.686515
4.582951
-1.693493
other
Li12Y8B12O36
68
14
676.1
mp-17881
14.326512
7.304774
-5.765644
other
Sr4Fe4P8O28
44
14
588.02
mp-1195336
-2.351739
-0.49759
-5.311936
other
Ce4Tl4P8S28
44
14
1,123.22
mp-1333042
10.248023
12.039823
-1.641986
other
Mg4Cu2W2O12
20
14
220.74
mp-1212751
8.419214
7.942781
-4.426706
other
Fe2P4Pb4O20
30
14
400.21
mp-1199403
8.863967
6.83101
-5.148905
other
Al8P8N4O44
64
14
915.44
mp-1182419
8.720347
6.640242
-5.312641
other
Co2P12N8O44
66
14
1,059.49
mp-1204289
-4.506362
-2.851917
-3.607531
other
Cs32Bi8As24Se56
120
14
4,719.16
mp-1211769
8.028854
6.79577
-4.770884
other
K4Yb4S8O40
56
14
898.69
mp-561218
-2.912027
-0.742466
-5.342993
other
K4P8Au20S32
64
14
1,748.4
mp-1182771
11.365491
10.65064
-2.714179
other
K4U4V4O24
36
14
806.25
mp-758145
14.536168
7.862521
-4.926112
other
Li4Ti4P8O28
44
14
512.85
mp-541211
7.887587
10.012038
-3.801546
other
K4La4Cr8O32
48
14
716.3
mp-673023
12.551589
6.711494
-6.679576
other
Li4Bi4P16O48
72
14
984.26
mp-1208544
2.676848
2.276439
1.809516
other
Tb8Si16C4N24
52
14
620.01
mp-759016
13.906134
8.176703
-1.007128
other
Li8Fe8Si8O28
52
14
619.64
mp-1199251
13.315976
4.386792
-2.714774
other
K4B20H16O40
80
14
833.95
mp-10321
7.732044
10.466553
1.568354
other
La4Zn2Rh2O12
20
14
257.62
mp-1047848
9.124946
1.933484
1.516343
other
Ba4Mg4Mo4F28
40
14
583.08
mp-1197498
11.684984
4.496104
-4.855455
other
Tb4P8H36O44
92
14
905.97
mp-849317
13.798805
8.855325
-7.488524
other
Li8V8P12O48
76
14
910.58
mp-1181025
1.224733
2.230983
-4.236667
other
K2Au2Br8O4
16
14
514.93
mp-757976
8.006509
4.890292
-6.734893
other
Li4Ni4C4O16
28
14
262.62
mp-1195958
8.332149
7.97378
-4.286537
other
Cu4Ag4As8O32
48
14
638.82
mp-553980
-2.721486
-0.656041
-5.250248
other
Cs4Ni2P4S12
22
14
604.47
mp-569902
2.666455
2.887414
-4.355518
other
Ga4Se12N8Cl20
44
14
1,297.72
mp-769254
12.612647
7.514098
-4.482933
other
Li8Cu4As4O16
32
14
393.83
mp-706408
11.641423
4.582661
-4.821225
other
Nd4P12H48O60
124
14
1,321.49
mp-1180831
1.256455
2.242913
-4.20928
other
K2Au2Br8O4
16
14
511.09
mp-558075
11.169785
11.096222
-3.636675
other
K16U8Mo16O80
120
14
2,263.58
mp-1203127
11.539723
5.293658
-5.266926
other
Fe6P8H24O40
78
14
786.45
mp-984806
7.796556
10.264345
1.603826
other
Ba4Pr2Ru2O12
20
14
319.43
mp-736701
10.572354
7.06849
-5.166266
other
P16Pt4I4O40
64
14
3,585.99
mp-26083
14.078428
7.566403
-7.219925
other
Li4Mn6P8O28
46
14
552.77
mp-1292643
10.673792
11.974475
-1.601857
other
Mg4Co2W2O12
20
14
214.97
mp-770693
9.363415
12.307417
-0.476988
other
Li12Mn4Al8O24
48
14
488.64
mp-583184
-3.593313
-1.464382
-5.531679
other
Tl12Ag12As8S24
56
14
1,429.7
mp-1212171
6.300207
4.98874
-4.622718
other
Li12Y4N24O72
112
14
1,480.06
mp-769287
-3.593375
-1.440813
-6.00211
other
Li8Ti4S8O4
24
14
413.31
mp-1044511
8.968633
0.611988
0.656983
other
Ba4Ca4Cu4F28
40
14
593.68
mp-776547
10.473256
6.882011
-3.659092
other
Li4Fe2B4O12
22
14
214.56
mp-1196353
-3.279934
1.510886
2.720537
other
Cs8B24N4O8
44
14
1,012.04
mp-1223352
8.270667
11.072843
2.271807
other
La4Mn2Ga2O12
20
14
249.7
mp-757776
12.938249
7.438144
-7.357358
other
Li8Co4P8O28
48
14
544.6
mp-567864
-4.087432
-2.462279
-3.429314
other
Tl4Bi4P8Se24
40
14
1,100.52
mp-757189
14.722864
8.623265
-3.74556
other
Li8V8P8O32
56
14
638.65
mp-756995
8.87961
8.149366
-4.960716
other
Li4Fe4P4O20
32
14
360.5
mp-6604
9.123488
0.904854
1.336319
other
Na4Li2Al2F12
20
14
220.16
mp-1211562
6.844126
10.421175
0.288249
other
Li2Eu4Ru2O12
20
14
236.26
mp-1220545
7.834525
11.59977
1.94554
other
Nd4Mn2Fe2O12
20
14
247.02
mp-695843
10.02249
3.233236
-3.796878
other
Sb4H28Br24O12
68
14
1,290.54
mp-1211486
12.983564
5.37802
-0.665344
other
Li4Pr24B12O56
96
14
1,305.79
mp-690711
12.122391
4.962751
-5.141355
other
Tl4P4H8O16
32
14
444.72
mp-1197695
8.523147
7.079092
-3.851108
other
Rb4U4Se8O32
48
14
944.8
mp-1224209
10.460815
11.224937
3.13726
other
Ho4Ta4Ti4O24
36
14
432.46
mp-1196153
8.457084
1.020605
1.802356
other
K8Li8Y8F40
64
14
922.37
mp-554059
10.377367
9.395168
2.524947
other
Sr4U2Zn2O12
20
14
286.1
mp-560100
13.241475
5.214895
-2.837782
other
Cd4Cu8B8O24
44
14
514.94
mp-759926
13.758558
4.692177
-2.299778
other
Li8Ti4B8O24
44
14
472.21
mp-1210419
8.742097
2.19981
0.015274
other
Np4Co2H16F20
42
14
640.6
mp-1212356
8.22626
10.698627
1.475091
other
Ho4Co2Pt2O12
20
14
236.21
mp-776632
11.452366
8.068306
-8.069114
other
Li4Mn16P24O84
128
14
1,635.13
mp-1047825
11.618602
7.336152
-1.993788
other
Be12Fe8Si12O48
80
14
837.21
mp-1194023
12.71736
7.132371
-6.75949
other
Ba2Co4P4O16
26
14
389
mp-1210320
10.268055
4.321784
-6.952633
other
Na12Fe2S8O32
54
14
716.52
mp-705520
7.937504
4.352113
-4.699432
other
Sn12H16N8O40
76
14
1,046.94
mp-706411
5.975579
3.447732
-4.721123
other
Fe16Sn4C64O64
148
14
2,538.11
mp-1205080
12.647981
6.014546
-5.224393
other
Ba8P4I4O16
32
14
731.84
mp-1213543
10.207294
4.538295
-5.903079
other
Cs4H12S8O32
56
14
855.03
mp-1191826
-4.493168
-2.925428
-3.545441
other
K4Ba4As4Se12
24
14
794.24
mp-1201842
9.62127
4.695173
-6.101661
other
K20Ag4S24O36
84
14
1,685.88
mp-557858
12.130844
8.350695
0.597874
other
Cs12U8Ge8O44
72
14
1,425.4
mp-707905
10.02181
2.546822
-4.352207
other
P8H56N16O24
104
14
907.85
mp-1199026
11.347573
7.282396
1.469561
other
Tb16B4Cl4O28
52
14
754.85
mp-757627
14.57719
8.694787
-3.558511
other
Li4V12P12O44
72
14
872.85
mp-761095
8.95855
14.942478
-0.13575
other
Li12Ti6Mn12O36
66
14
730.46
mp-23575
7.654293
2.392159
-1.499828
other
As4Se12Cl12F24
52
14
1,231.89
mp-1213116
-4.598907
-2.02884
-3.216356
other
Cu4Te4Se4Cl4
16
14
438.75
mp-555436
8.122591
3.783929
-4.469597
other
S20N8O32F16
76
14
1,266.42
mp-558077
9.166033
1.150004
1.121217
other
Ba6Na4Cr8F40
58
14
864.89
mp-768795
13.765045
4.805318
-2.325799
other
Li8Bi8B16O40
72
14
796.75
mp-864887
7.601677
4.341599
-4.626608
other
Mg2H8N4O16
30
14
300.28
mp-17262
11.182382
7.628545
-4.29295
other
Ba2Cu4As4O16
26
14
382.64
mp-1214198
8.384701
3.655398
-6.501749
other
Ca8H8C16O32
64
14
898.29
mp-504206
12.882621
8.060644
-7.423862
other
Li4V4P20O60
88
14
1,239.28
mp-557123
12.621436
6.368172
-0.953872
other
Na8Cu4Si12O32
56
14
781.56