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-1204227
6.373586
5.760331
-4.390357
other
Al4N12O72
88
14
1,811.93
mp-777680
9.880465
2.13472
1.656324
other
Li8V4F20
32
14
427.33
mp-541379
-3.411636
-1.371138
-5.49754
other
K8Sn8S32
48
14
1,323.49
mp-771643
-1.195004
2.037887
-1.864976
other
Sr8Ca4I24
36
14
1,470.51
mp-31314
-4.208039
-2.601213
-3.490277
other
K16P8Se24
48
14
1,520.51
mp-1102554
7.410623
10.033827
-2.232626
other
Cu4Cl4O4
12
14
188.85
mp-754438
8.188236
11.210646
-0.495544
other
Na4Ni4O6
14
14
180.55
mp-569386
2.691769
2.775284
-4.492519
other
P24N8Cl96
128
14
3,450.54
mp-1195118
10.29846
9.181376
-1.99486
other
Ba4Te12O28
44
14
766.6
mp-1197398
11.12878
8.825323
0.713048
other
Na20U20O72
112
14
1,673.6
mp-1198989
12.974043
7.883496
-1.612331
other
Mn10Si4O20
34
14
399.25
mp-29401
-0.232793
0.413353
-3.379954
other
Er20C8Br36
64
14
1,824.36
mp-22552
8.57618
1.717445
-0.660278
other
Ni2Au4F16
22
14
298.9
mp-20742
-3.931764
-2.641692
-3.229552
other
Eu4P4Se12
20
14
531.12
mp-29279
8.170304
2.635197
-1.039442
other
Cu2Cl2F20
24
14
310.95
mp-1182655
7.325375
9.391788
-3.72343
other
Cr12Fe8O60
80
14
1,413.8
mp-1246328
1.57702
1.947187
2.177213
other
Ta4S4N4
12
14
165.01
mp-21760
-5.147128
-5.993747
0.439923
other
Rb16In16Sb24
56
14
2,114.54
mp-772226
11.715481
11.218961
-2.528976
other
Tm8W12O48
68
14
1,427.7
mp-728450
9.909899
10.891544
-3.141317
other
Nd4W4O20
28
14
461.91
mp-1213614
8.17
7.274421
-4.86599
other
In8P8O48
64
14
1,012.12
mp-753000
9.766678
10.149789
-1.198819
other
Na2Sb6O16
24
14
284.4
mp-1214186
7.010477
2.219084
-3.069838
other
C12I4F8
24
14
454.37
mp-1643785
6.894557
11.533987
0.38835
other
Sc4Co4O12
20
14
202.46
mp-1196071
7.525683
10.973336
1.072529
other
Ba28Fe28O70
126
14
1,993.02
mp-755893
6.110773
8.879877
-0.449437
other
Ca4Bi4O12
20
14
289.04
mp-771778
13.589293
5.606743
-6.894628
other
Tm8P16O52
76
14
1,114.25
mp-778968
9.133181
8.493691
0.375156
other
Rb12Dy4O12
28
14
665.03
mp-1247478
1.920341
2.049807
1.12853
other
Na12Nb4N8
24
14
437.78
mp-559637
7.586054
6.590334
-3.037419
other
Dy4I12O36
52
14
775.39
mp-1182597
4.136887
3.497143
-3.54741
other
Co4N32Cl8
44
14
1,009.02
mp-1204861
7.83521
6.469698
-4.603757
other
Sb4P4O24
32
14
589
mp-559051
6.183272
8.691814
-0.126352
other
Ba4Bi4O12
20
14
334.67
mp-1198809
7.951252
5.409176
-5.894356
other
Cu8C4O20
32
14
338.03
mp-1196789
12.693608
10.586947
0.471047
other
Pr32Mo42O112
186
14
2,567.18
mp-769322
10.647592
4.418954
-6.673763
other
Mg8S8O24
40
14
511.06
mp-762029
8.694894
0.962003
-0.104411
other
Li4Ag8F16
28
14
428
mp-29429
7.882696
2.766794
-2.315984
other
Te8C8F24
40
14
851.42
mp-1003636
8.366164
14.54011
-1.466128
other
Na4Mn16O32
52
14
592.34
mp-1178868
6.687463
6.058052
-3.689862
other
V2Cl6O12
20
14
327.33
mp-510471
-3.41318
-2.187315
-5.769878
other
Gd4Cu4S8
16
14
302.85
mp-1180599
6.250053
5.390347
-4.411815
other
Nd4N12O52
68
14
1,167.67
mp-694541
10.925331
7.955541
-6.960123
other
Fe4P4O16
24
14
372.11
mp-778231
7.86883
10.600141
-0.329203
other
Na32Co8O28
68
14
922.63
mp-29178
8.442372
1.788447
-0.316277
other
Te4Pb4F24
32
14
481.61
mp-768979
1.144414
1.745689
-5.227513
other
Ba12Y8Cl48
68
14
2,099.21
mp-778880
9.809432
8.168797
-6.508954
other
Co16P24O84
124
14
1,537.36
mp-1173640
10.719632
9.249987
-0.91041
other
Sb24I8O32
64
14
2,542.95
mp-505253
10.353856
10.876161
-4.236138
other
U4V4O22
30
14
518.21
mp-1192052
8.028567
8.478231
-3.07296
other
K4Te4O16
24
14
386.33
mp-760294
9.810221
2.19618
0.434498
other
Li8V8F40
56
14
776.5
mp-758181
9.937801
2.605428
2.128253
other
Li8V4F16
28
14
335.62
mp-3962
13.865721
5.025853
-6.666491
other
La4P4O16
24
14
306.59
mp-1204834
-0.252321
0.76175
-2.558673
other
Pr44C44Cl28
116
14
2,407.61
mp-1190936
8.473365
7.871192
-4.075329
other
Hg4As4O16
24
14
409.26
mp-1212265
-5.817978
-3.176855
-1.703768
other
K16Zr12Te68
96
14
3,468.72
mp-1188790
9.507032
10.612045
-1.294094
other
Cu2Sb4O12
18
14
201.94
mp-732231
9.352607
11.377043
-3.763827
other
Na16V8O32
56
14
841.82
mp-1196784
11.613215
7.619462
-2.784801
other
Zn12As8O24
44
14
671.58
mp-1212177
9.952282
10.699566
-3.772552
other
Ho4Mo4O20
28
14
413.43
mp-636978
1.428269
2.474974
-5.644758
other
K4Cu4Cl12
20
14
672.18
mp-725133
1.289703
2.475239
-3.419729
other
Te2I12N4
18
14
696.51
mp-1208290
-6.048148
-2.519486
-0.632973
other
Te4P4Os4
12
14
227.53
mp-1040952
13.308401
6.507258
-7.179514
other
Ti4P8O28
40
14
555.37
mp-29063
8.460614
1.333085
1.30556
other
Th8Zr8F64
80
14
1,177.2
mp-19155
7.761842
9.864529
-3.598163
other
Cr4Hg4O16
24
14
341.22
mp-556307
12.863221
6.13749
-0.708106
other
Na8Si8O20
36
14
482.63
mp-557260
8.436524
1.825588
0.434048
other
Rb4Sb8F28
40
14
694.05
mp-759681
12.895898
7.366943
-6.867702
other
Co4P16O44
64
14
880.14
mp-754037
8.781843
2.468369
-1.299063
other
Ni4O4F8
16
14
221.5
mp-1211375
-0.131893
0.98071
-3.938409
other
K4Sr8Br20
32
14
1,044.6
mp-557145
8.423555
2.10732
-0.914089
other
Cr4Sb4F40
48
14
647.75
mp-1205019
7.661722
8.064932
-3.974728
other
Zn4Mo8O48
60
14
1,005.7
mp-619747
-0.242046
0.95939
-4.162962
other
Na6Gd2Br12
20
14
597.46
mp-28670
9.139463
8.641862
0.80737
other
Ba4Bi4O10
18
14
341.11
mp-1203317
-5.14615
-3.538325
5.753115
other
Ho10Co8Si28
46
14
736.71
mp-1204932
7.68271
6.499485
-4.380271
other
Ca4B12O48
64
14
1,049.43
mp-12645
9.634304
8.775981
3.249163
other
Li4Ho4O8
16
14
202.56
mp-1211086
9.084054
11.251842
-4.134622
other
Mg2V16O48
66
14
968.21
mp-1213806
6.966312
7.267986
-3.742784
other
Co2I4O20
26
14
390.91
mp-28278
-4.626834
-2.944719
-3.759398
other
Na8Ge4Se12
24
14
636.86
mp-654080
12.928144
10.525985
-0.041635
other
La10Mo64O108
182
14
2,590.62
mp-1213905
-0.313893
1.120637
-4.743426
other
Cs12La4Br24
40
14
1,739.51
mp-4818
-3.576905
-1.39043
-5.163035
other
Rb4Sb8S14
26
14
755.8
mp-778086
8.381191
1.163254
1.830281
other
Ba12Y8F48
68
14
1,213.62
mp-29236
-5.611872
-2.897043
-2.662144
other
In4Te4Br4
12
14
441.83
mp-1020947
13.382105
5.903086
-6.845438
other
Y12P36O108
156
14
2,370.31
mp-28643
8.019291
1.988068
-4.42021
other
H36C4N36
76
14
705.56
mp-849230
13.273348
6.413412
-6.253714
other
Ba4P16O44
64
14
1,201.51
mp-565679
9.622698
7.580173
-3.225812
other
Hg16Se16O36
68
14
1,292.63
mp-3739
-4.340045
-3.999709
-3.958299
other
Nd4Cu4Se8
16
14
359.71
mp-554676
8.064421
0.699418
-4.437961
other
H24C8S8
40
14
522.7
mp-733717
-4.560792
-3.082201
-4.003743
other
Tl12Sn4Se16
32
14
1,064.32
mp-966582
3.409491
-0.740834
-2.413434
other
Ca8Al8H40
56
14
556.2
mp-1201853
7.070416
4.82765
-5.093712
other
Sr4C12O28
44
14
790.16
mp-1200135
6.337858
5.497913
-4.334391
other
Ca4N8O40
52
14
804.52
mp-29912
-6.180445
-2.771268
-0.111344
other
Sb16Mo8Se8
32
14
812.69
mp-19396
8.330973
10.973138
-0.190506
other
Na16Fe8O20
44
14
619.55
mp-1211890
1.23693
2.180557
-5.714508
other
K12Y4Cl24
40
14
1,193.93
mp-510637
8.455829
9.744992
-0.094819
other
Eu4Sb4O16
24
14
310.4