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-1042399
11.257028
7.70673
-4.270945
other
Mg4Cu4As8O28
44
14
553.93
mp-1202729
8.244383
4.095588
-4.504042
other
Ca8H64N16O80
168
14
1,702.16
mp-554950
-3.5404
-1.169885
-5.581703
other
Hg12Sb4As4S12
32
14
878.75
mp-772409
14.680362
7.809598
-5.913985
other
Li12Fe12P12O48
84
14
961.63
mp-657353
8.40325
6.26414
-3.518186
other
Ba4Zn4Se8O24
40
14
758.56
mp-765999
8.902875
3.555786
-7.595886
other
Li4V4C4O16
28
14
281.16
mp-1193552
7.494239
4.688896
-4.562863
other
Ni2H8N4O16
30
14
316.46
mp-1212514
7.917626
2.495919
-4.591536
other
H4C12Cl4O8
28
14
387.53
mp-571240
0.813025
1.29864
-4.146883
other
K4La20C8Cl40
72
14
1,973.95
mp-556279
11.213116
10.914341
-3.616074
other
K8Ni8Mo12O48
76
14
1,229.38
mp-768678
10.222854
4.394052
-7.027704
other
Li4Sn8S12O48
72
14
1,087.4
mp-680280
5.553303
3.346136
-4.630732
other
Ru12C40N8O48
108
14
1,810.8
mp-705061
10.897206
11.085101
-2.543883
other
U4Ag8W8O40
60
14
861.26
mp-557289
3.001909
2.852206
-4.572398
other
Ti4P8Cl32O12
56
14
1,372.74
mp-1192570
11.542801
7.386113
-2.142945
other
Li4Fe4Si4O16
28
14
340.46
mp-1209770
8.608794
10.857784
1.635142
other
Pr4Co2Ru2O12
20
14
252
mp-1208759
10.025851
9.708583
3.574737
other
Sr4Nd2Ta2O12
20
14
302.49
mp-1203095
11.716464
5.550395
-2.726459
other
Sm4B28I4O60
96
14
1,387.88
mp-1210310
7.579434
6.348775
-4.835167
other
Rb4Pr4S8O48
64
14
1,179.05
mp-1200673
10.301367
3.174477
-3.947521
other
Mg4H72I8O36
120
14
1,412.72
mp-1178433
9.468995
4.888701
-4.920475
other
Co2H16S4O24
46
14
533.48
mp-1194683
8.296166
2.117094
-0.840606
other
Hg4As8H4F52
68
14
1,012.87
mp-1215031
7.849741
2.713602
-2.376463
other
B4C40Xe4F68
116
14
1,605.68
mp-1214729
8.923519
5.087646
-5.431108
other
Ba4H8S16O24
52
14
1,040.32
mp-14665
10.659144
4.161881
-7.008383
other
K4Nd4S8O32
48
14
644.49
mp-1182542
4.536806
2.780859
-3.756154
other
Cu8C16N4Cl20
48
14
1,339.29
mp-1020031
2.262075
1.972675
1.596502
other
Li4Ca4Al4N8
20
14
232.86
mp-757868
8.157348
11.663722
-0.192746
other
K8Li12Co4O16
40
14
506.42
mp-1208875
5.883811
8.503548
-0.00743
other
Sr4Er2Bi2O12
20
14
302.94
mp-557417
7.933128
2.398619
-1.321689
other
As8Cl12O4F20
44
14
919.04
mp-1301502
9.018931
14.708112
-0.342208
other
Li4Mn6Nb2O16
28
14
321.49
mp-557238
10.461789
12.176646
-3.527319
other
Mg8V16Pb8O56
88
14
1,233.71
mp-1041401
11.848065
11.163884
-2.025559
other
Mg4Cu8W8O32
52
14
732.95
mp-554226
11.123197
11.06338
-3.650509
other
Rb16U8Mo16O80
120
14
2,418.78
mp-1195547
-4.109476
-2.455347
-3.241415
other
La4Tl4P8Se24
40
14
1,112.22
mp-735531
10.109165
3.243536
-3.942663
other
Ni4H32Cl8O16
60
14
619.59
mp-757644
8.977753
3.606508
-7.385887
other
Li8Fe8C8O28
52
14
555.36
mp-572864
-2.588718
-0.584859
-5.290462
other
Rb20Th4P12S48
84
14
2,525.94
mp-726503
2.960251
2.854812
-4.138858
other
Sb8C8N8Cl64
88
14
2,675.6
mp-697758
11.538268
7.692144
-7.612975
other
Li4Fe4P8O28
44
14
520.01
mp-1196022
5.364781
-0.500275
-3.019527
other
Na4Zn4B12H48
68
14
711.55
mp-1047088
10.67732
12.614242
-1.329175
other
V2Zn4Ir2O12
20
14
205.53
mp-19377
10.372952
10.571507
1.6335
other
Li2La4Mo2O12
20
14
262.35
mp-1250945
11.476544
7.2284
-2.202551
other
Mn8Be12Si12O48
80
14
836.99
mp-1217181
12.867677
8.750478
-5.680626
other
Tl4Mo8P12O52
76
14
1,128.08
mp-1198127
8.387068
2.163603
-0.744157
other
Sb2P4Au2F24
32
14
575.87
mp-1196296
7.215044
7.52827
-3.937522
other
Fe8As4S4O56
72
14
1,237.03
mp-1201156
8.897216
7.773494
-2.239516
other
Ca8Si4O16F4
32
14
419.8
mp-17337
8.383773
1.753892
-0.374239
other
Rb4As4O4F16
28
14
476.37
mp-1044332
7.136559
10.217133
-1.612846
other
Ca4Mn4Bi4O20
32
14
531.07
mp-769374
13.96909
4.613037
-2.361935
other
Li8B20Sb4O40
72
14
802.52
mp-560450
8.042578
2.27628
-1.031969
other
Sb8S4N4F44
60
14
1,048.17
mp-1217718
9.288821
10.090835
1.798622
other
Tb4Al2Fe2O12
20
14
214.55
mp-707250
10.971203
3.969865
-4.052216
other
Ca2Zn4H20O16
42
14
411.81
mp-18897
10.967796
10.363611
-3.058701
other
Na4V4Te4O20
32
14
469.89
mp-555707
6.453216
3.722117
-4.301861
other
S16N8O12F4
40
14
731.39
mp-1213269
9.723987
8.020776
-2.43255
other
Eu4Fe4Ge8O28
44
14
550.29
mp-562901
14.407159
7.998761
-6.430785
other
Cs4V4P8O28
44
14
656.01
mp-1202030
12.24157
6.884302
0.06134
other
Ce8Al4Si8O36
56
14
685.65
mp-1197534
7.69585
0.587944
-3.998122
other
Ca4B8H52N12
76
14
697.14
mp-1198094
12.012994
7.578822
-0.741594
other
Cs8U2Ge16O40
66
14
1,137.74
mp-1106155
9.938945
11.027396
1.039753
other
Ca8Mn4Re4O24
40
14
470.55
mp-557747
13.150779
5.616937
-6.086098
other
K8Sr4P8O28
48
14
774.08
mp-850982
10.19224
0.696702
-1.286744
other
Li2Co6O4F12
24
14
257.04
mp-560010
13.594373
4.575541
-2.179728
other
Rb8Ga8B8O28
52
14
827.53
mp-26701
13.786656
6.85329
-6.337027
other
Li12Sn8P12O48
80
14
1,028.27
mp-758745
13.039072
7.905755
-1.178464
other
Li8Cr8Si8O32
56
14
606.78
mp-541096
11.514157
9.758213
1.585278
other
Cs4U4Nb4O24
36
14
712.82
mp-645095
11.264561
7.871076
-3.884727
other
U8Ag24As24O96
152
14
2,298.19
mp-559721
8.353413
2.132168
-1.081645
other
K4B4C4F24
36
14
513.42
mp-1200926
9.464929
7.838569
-4.112778
other
Sc4V4Se8O32
48
14
683.75
mp-1337388
7.535572
9.895608
1.582422
other
Ba12Y20Cu12O60
104
14
1,505.01
mp-697236
9.564226
6.362208
-3.870862
other
Mg2H4Se4O12
22
14
280.73
mp-558293
13.8037
4.129176
-2.294812
other
K8Na4B36O60
108
14
1,290.07
mp-652092
5.973527
3.447923
-4.71891
other
Fe16Pb4C64O64
148
14
2,663.91
mp-1198731
12.815527
6.324288
-0.381512
other
Na4Tb4Si8O24
40
14
527.89
mp-1211435
8.40172
0.991142
1.755451
other
K4Li4Tb4F20
32
14
434.36
mp-17433
9.360212
9.418498
0.907257
other
Na2Sr8Sb6O24
40
14
556.07
mp-732352
7.295708
5.015942
-5.067619
other
K4Pd2C8O24
38
14
642.18
mp-560889
11.961991
6.618943
0.054146
other
Ba12Na4Si8O30
54
14
830.49
mp-1205292
7.46543
7.53088
-4.05909
other
U8Ni6O52F28
94
14
1,587.79
mp-1020656
13.154821
6.027231
-6.761651
other
Rb4Y4P16O48
72
14
1,000.97
mp-1042775
11.279996
7.786277
-4.377529
other
Zn4Co4As8O28
44
14
567.97
mp-554353
4.104904
2.862056
-4.026317
other
Ti4S16N20Cl20
60
14
1,331.76
mp-1226407
7.322199
11.40111
0.755256
other
Dy4Mn2Co2O12
20
14
262.82
mp-1223233
10.582137
11.142179
1.389545
other
La4V2Fe2O12
20
14
251.05
mp-557581
8.477146
3.296626
-5.701945
other
Zn12H24C24O48
108
14
1,714.48
mp-770926
13.163733
5.778947
-2.987863
other
Li12Fe4B8O24
48
14
457.27
mp-1198268
8.032195
6.493055
-5.024879
other
H8S8N8O32
56
14
1,092.69
mp-1212434
-2.942677
-0.220649
-2.88182
other
Hf4Te28Se4Cl24
60
14
2,061.98
mp-1105237
7.566342
8.890162
-0.070009
other
Sr4Yb2Sb2O12
20
14
291.17
mp-726441
7.191022
4.874851
-5.19847
other
U4C12N4O32
52
14
904.76
mp-1225208
9.179682
2.795491
-4.927032
other
H48C16N8O36
108
14
989.66
mp-744930
10.981519
4.469184
-4.525155
other
Fe4H24S4O24
56
14
538.74
mp-556577
10.964664
8.209414
-2.939956
other
Na6Sb6As4O28
44
14
563.02
mp-1105147
8.694763
10.416381
1.557841
other
Sr4Y2Os2O12
20
14
284.77
mp-758338
12.922511
7.256774
-1.468377
other
Li8Co8Si8O28
52
14
599.6
mp-1370320
7.575381
12.764584
-1.350609
other
Zn4Co2Ir2O12
20
14
198.96
mp-1043589
10.171551
9.30723
-0.925365
other
Zn4Bi4Sb4O20
32
14
509.14
mp-554096
-0.89099
1.025936
-4.860694
other
Sn4Hg8S8Br8
28
14
1,225.59