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-771595
13.288203
6.915513
-7.249688
other
Ti4Ni2P4O20
30
14
352.34
mp-1215802
8.005296
9.250682
-1.040187
other
Yb4Ta4Ti4O24
36
14
438.71
mp-780661
9.745915
11.992511
-1.834467
other
Li12Fe12W8O48
80
14
1,060.4
mp-1208881
7.729007
9.120483
0.522779
other
Sr4Ca2Sb2O12
20
14
295.68
mp-650978
5.603541
3.260336
-4.73802
other
Ru20C56S8O56
140
14
2,578.95
mp-6353
2.655304
2.277611
1.815674
other
Y8Si16C4N24
52
14
607.08
mp-1211681
9.034851
6.748972
-3.874849
other
K4Sm4Se8O32
48
14
735.93
mp-1044037
14.383558
7.846875
-5.60801
other
Zn2Fe6P8O28
44
14
505.84
mp-1204132
8.413011
2.237285
-4.924229
other
Zn12H56C40O52
160
14
1,834.85
mp-1044124
12.216901
7.063799
-7.072685
other
Mg4Cu4P8O28
44
14
501.9
mp-1048376
13.08108
7.295368
-6.855426
other
Ca4Co4P8O28
44
14
531.87
mp-1200025
9.738791
7.334402
-5.151567
other
Ca4Be4P4O20
32
14
373.43
mp-1204199
8.612623
5.685023
-5.894366
other
K16Cd8S16O76
116
14
1,915.06
mp-734902
8.29915
5.649729
-5.392923
other
K16Cd8S16O76
116
14
1,992.31
mp-16165
12.49307
6.501524
0.205313
other
Ho12Si12O40F4
68
14
856.15
mp-621092
4.158123
2.240567
-3.199359
other
Tl4Pt2C8N8
22
14
434.68
mp-1228588
10.53854
11.601347
2.918868
other
Ba4Ti6Nb8O36
54
14
716.42
mp-559719
11.277809
3.88624
-7.619097
other
Li4Pr4S8O32
48
14
646.77
mp-696956
3.299724
3.395057
-4.182
other
Cu4H4Cl4O4
16
14
285.9
mp-1197623
10.05625
2.315091
-4.338585
other
P8H72N16O32
128
14
1,140.05
mp-1043781
10.638072
10.108036
1.916913
other
Ca4Ta4Bi4O20
32
14
579.86
mp-1213659
8.196252
9.710413
-1.378816
other
Eu12V4Ge4O36
56
14
794.15
mp-556109
11.344466
10.977908
-3.707583
other
K24Co4Mo20O76
124
14
2,155.19
mp-1203601
7.825201
7.116458
-4.360875
other
U4Se8N4O32
48
14
942.87
mp-561402
13.191252
7.775214
-6.921503
other
K4Fe8P8O32
52
14
685.03
mp-25943
12.297841
7.210803
-7.350858
other
Li8Cu4P8O28
48
14
538.66
mp-559489
13.009575
6.018116
-0.773464
other
K8Zr4Si8O28
48
14
701.82
mp-1180977
6.424765
5.68615
-4.341092
other
K8Os4N8O40
60
14
1,040.03
mp-1197213
9.739001
5.214376
-6.419873
other
Pu4Te4S4O28
40
14
550.68
mp-1042831
12.591914
8.020288
-0.637765
other
Mg4Ti4Ge8O24
40
14
532.08
mp-1179238
7.250093
6.835548
-4.375539
other
Zn4Fe4S8O64
80
14
1,234.94
mp-560158
13.804781
4.207309
-2.269071
other
Na12Zn4B20O40
76
14
845.28
mp-18215
14.60239
7.713136
-5.532452
other
Sr2Fe6P8O28
44
14
541.91
mp-24502
10.137118
4.713264
-5.912564
other
Zn2H4S4O16
26
14
308.46
mp-1181610
7.74482
7.481499
-3.91871
other
K8Mo4Se8O44
64
14
1,162.48
mp-720312
13.456115
4.309773
-2.678597
other
Na16B40H24O80
160
14
1,571.62
mp-1212336
11.525705
7.053279
0.552548
other
La28B4P8O68
108
14
1,599.71
mp-1197769
-3.334068
-1.258124
-5.39217
other
Rb4Sb16S28O4
52
14
1,565.18
mp-775905
14.041637
7.303414
-7.033505
other
Li8Mn4P8O28
48
14
578.47
mp-651122
5.815269
3.423689
-4.677371
other
Mn12Bi4C60O60
136
14
2,285.34
mp-11982
9.566178
9.190794
0.254603
other
Sr4Ca2Te2O12
20
14
288.48
mp-758410
13.794988
8.652697
-5.396511
other
Li4P12W8O52
76
14
1,031.89
mp-704836
12.135527
6.941328
-1.729194
other
Ca4Ti4Si4O20
32
14
532.95
mp-573001
13.097353
6.062702
-6.72085
other
Cs4Gd4P16O48
72
14
1,032.94
mp-17107
13.078998
6.955569
-6.744781
other
Sr4Co4P8O28
44
14
553.6
mp-753696
10.403795
8.987242
-6.801076
other
Li2V2P4O16
24
14
276.33
mp-707317
13.117558
6.225188
-6.671341
other
Er4P16H4O48
72
14
948.27
mp-1195152
10.84725
12.169497
-3.564491
other
Ba12V16Zn4O56
88
14
1,404.39
mp-1208644
6.255145
5.872458
-4.540106
other
Th2Mn2N12O52
68
14
937.59
mp-553954
8.302637
2.108617
-1.444656
other
B32C8O8F48
96
14
1,455.35
mp-766466
11.84103
5.937398
-3.438154
other
Li8Mn4B8O24
44
14
436.92
mp-19487
13.768152
6.294995
-5.858171
other
Ba8Mn4P8O32
52
14
811.59
mp-708965
8.299737
2.582506
-4.634297
other
H32C12N16O16
76
14
760.34
mp-1203203
7.995776
5.530857
-5.857115
other
Zn4Cu4C4O20
32
14
356.25
mp-561190
8.868589
5.580247
-5.851003
other
Na2Au2S4O16
24
14
351.71
mp-1203000
10.454803
4.181137
-5.291452
other
Nd4H44S12O64
124
14
1,332.03
mp-21560
11.237409
7.60189
-4.011997
other
Cu4As8Pb4O28
44
14
641.2
mp-1202806
8.44535
1.75572
-0.637365
other
Mg4H4Au8F44
60
14
844.02
mp-6099
13.014886
6.430792
-0.382694
other
Li4Sc4Si8O24
40
14
455.39
mp-553970
-3.636353
-1.554832
-5.346209
other
Cs4Ge4Bi4S16
28
14
854.21
mp-1213085
10.268418
9.599523
3.304881
other
Dy4Mg2Ti2O12
20
14
231.67
mp-555871
-3.910417
-1.487258
-5.513215
other
Na8Cu4Sb4S12
28
14
616.32
mp-1212476
6.304771
4.994014
-4.61701
other
Li12Gd4N24O72
112
14
1,471.48
mp-26467
11.351564
7.474189
-7.265625
other
Li4Cu4P4O16
28
14
336.64
mp-26805
11.801988
7.575499
-7.820791
other
Li12Fe4P8O32
56
14
564.72
mp-643125
13.023826
6.564354
-6.702326
other
Cs8Co4P16O48
76
14
1,285.25
mp-1196460
13.307421
4.426887
-2.782269
other
Zn4B12H12O28
56
14
517.94
mp-1935909
8.353736
10.851593
-3.488769
other
Mg4Cr8Cu8O32
52
14
637.71
mp-757187
9.472659
8.075719
-5.762452
other
Li4Fe2P4O16
26
14
313.09
mp-1196585
5.670037
3.407174
-4.646102
other
Mn8C32Cl8O32
80
14
1,432.66
mp-1019737
12.028985
6.777949
-6.952753
other
K4Eu4P16O48
72
14
1,034.37
mp-26639
10.45063
8.242984
-7.217409
other
Li4Co4P8O28
44
14
473.5
mp-1212531
8.427181
2.528759
-1.295964
other
Hf2Cu2O8F12
24
14
342.66
mp-1197363
10.392307
4.017941
-4.57225
other
Zn4H32S4O32
72
14
662.77
mp-17461
14.523597
7.706598
-4.967189
other
Na4Ti4P8O28
44
14
550.15
mp-1205069
3.176388
3.177416
-3.9232
other
Co4Sn4N24Cl20
52
14
1,721.6
mp-643154
14.66261
8.519101
-6.596375
other
Li12V8P12O48
80
14
944.66
mp-1182041
7.029101
6.728649
-4.194042
other
Fe4S4Cl4O40
52
14
1,085.77
mp-764414
6.733997
11.083403
-1.108135
other
K8Li8Ni4O16
36
14
507.22
mp-1204713
5.374144
-0.479065
-3.026979
other
Li8Zn8B24H96
136
14
1,334.43
mp-1202880
13.564226
4.381681
-2.553277
other
Ba4B32H16O60
112
14
1,160.97
mp-1212992
6.922006
10.157398
-0.125645
other
Eu4Zn2Pt2O12
20
14
251.3
mp-6373
11.473111
7.722593
-7.787434
other
Li12Fe8P12O48
80
14
935.97
mp-1182586
7.212408
5.681128
-4.382506
other
Ba4Te4S16O36
60
14
1,258.64
mp-1194625
10.209506
8.882838
-3.548557
other
Rb8Mo12Se12O64
96
14
1,625.91
mp-818283
9.111503
8.141616
-4.432858
other
Fe4As8Pb4O32
48
14
652.67
mp-1194745
11.261738
5.539043
-2.979414
other
Fe2B24H8O48
82
14
880.45
mp-542785
9.263818
3.299305
-5.219957
other
Mg4H24C8O24
60
14
588.68
mp-541041
13.047129
6.252266
-6.451766
other
Nd4Ag4P16O48
72
14
992.14
mp-1202517
9.706479
4.780955
-5.92089
other
K24H8S24O40
96
14
1,835.9
mp-1208769
14.076772
6.889777
-6.429297
other
Sr4Mn4P8O28
44
14
599.84
mp-1182274
5.910608
4.039221
-4.315236
other
Cu2C8N8O16
34
14
842.17
mp-1041016
9.97074
9.647185
-2.258048
other
Zn4Cu8Te8O32
52
14
737.47
mp-734944
4.709467
2.96214
-3.968789
other
Co8H16S32N32
88
14
1,940.94
mp-653596
6.041355
3.490552
-4.757888
other
Fe16Si4C64O64
148
14
2,401.7
mp-707231
12.996349
7.469886
-4.656514
other
As8P4H4O24
40
14
626.75
mp-582483
13.816507
4.9796
-6.751852
other
Na16Th8P16O64
104
14
1,350.08
mp-768913
14.642369
6.125889
-2.024257
other
Li4V4B8O20
36
14
372.02
mp-775830
13.438052
4.863946
-2.869058
other
Na12Bi4B8O24
48
14
659.21
mp-1204210
9.664489
1.683694
-3.623843
other
U4H72N20F28
124
14
1,111.82