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-17651
8.452875
1.639196
-0.069564
other
Ho4Pt4F28
36
14
494.84
mp-9236
-5.661055
-1.900881
4.293825
other
U4Si8Mo6
18
14
303.36
mp-768416
-0.219045
0.770489
-3.759115
other
Ba8Y8Br40
56
14
2,273.97
mp-21926
8.401403
11.727919
-0.38705
other
Sr8Fe16O32
56
14
798.76
mp-560772
13.853186
4.592224
-2.052585
other
Mg8B8O20
36
14
341.71
mp-1198708
6.893306
6.300271
-3.743546
other
Ho4I4O36
44
14
743.24
mp-705035
13.396114
8.06835
-6.188679
other
Mo4P16O48
68
14
942.54
mp-561511
-5.595511
-1.219165
-3.615936
other
Fe4As4S4
12
14
170.4
mp-29222
12.743187
6.270029
-0.505983
other
Ba8Si12O32
52
14
825.61
mp-543107
7.995307
8.181844
-4.032265
other
Fe8As12O48
68
14
964.75
mp-1020608
12.882193
6.290972
-6.49949
other
Si2P4O14
20
14
194.14
mp-778019
10.603907
3.574973
-4.143853
other
Ag8H64O36
108
14
973.52
mp-30236
-4.457153
-2.613227
-3.622405
other
Tl16As16Se32
64
14
1,917.5
mp-8198
8.313171
9.660465
-0.2832
other
Rb12Cu20O16
48
14
993.49
mp-673705
-4.050586
-2.473858
-3.483441
other
Sn4P4Se12
20
14
604.31
mp-561343
10.169385
9.581097
-1.981824
other
Fe12Te16O48
76
14
1,063.89
mp-1196497
12.270706
6.862404
-6.115376
other
Th4P16O48
68
14
1,214.79
mp-26662
9.291159
8.297167
-6.046302
other
Co4P8O28
40
14
475.56
mp-1204332
7.797262
9.631104
-3.734228
other
Y8Cr8O40
56
14
802.28
mp-4599
10.460458
9.47562
-1.766174
other
Ce4Te8O24
36
14
550.03
mp-753716
-1.205597
1.920014
-1.800226
other
Ba2Ca4I12
18
14
864.26
mp-27643
1.379011
2.629681
-5.461549
other
K12Mo4Cl24
40
14
1,109.4
mp-558637
9.993767
9.370884
-2.07019
other
Ag8Te8O24
40
14
574.83
mp-996962
6.718688
10.300638
-1.231723
other
Li2Ag2O4
8
14
89.54
mp-29402
-1.245506
2.666287
-2.716079
other
K4Ga4I16
24
14
1,084.97
mp-1103374
-6.496549
-3.332754
-0.623846
other
Bi4Os4Se4
12
14
262.29
mp-1198332
6.602415
6.582808
-4.282745
other
Zn12N8O40
60
14
812.62
mp-849361
10.069384
2.231744
0.558527
other
Li4V4F20
28
14
334.87
mp-780454
-1.190815
2.005778
-1.903526
other
Sr4Ca8I24
36
14
1,585.46
mp-771388
10.27985
8.312188
-7.172888
other
Mn4P8O28
40
14
466.36
mp-777525
10.078831
0.554323
0.382292
other
Li4Fe4F16
24
14
311.28
mp-27157
10.162328
11.979667
-3.768539
other
V8Ni8O28
44
14
493.01
mp-627023
10.697135
3.979274
-3.496041
other
Ba8H16O16
40
14
527.12
mp-1245714
2.946617
2.227266
0.697085
other
Sr16C8N20
44
14
660.97
mp-1214145
7.446279
2.677876
-3.085736
other
C12O4F8
24
14
334.83
mp-831249
10.609452
12.55257
-3.977454
other
V16Cr8O52
76
14
1,155.18
mp-30998
6.188661
5.02885
-4.597241
other
Ti4N16O48
68
14
874.77
mp-556061
8.317979
1.821443
-0.370293
other
Cs4Sb8F44
56
14
930.91
mp-26594
10.079265
7.618382
-6.002943
other
Bi4P8O28
40
14
644.56
mp-583762
1.551926
3.038348
-4.750107
other
Na12W12Cl52
76
14
1,877.65
mp-752575
-1.25943
1.943058
-1.645578
other
Ba4Sr4I16
24
14
1,243.91
mp-1181233
7.405025
6.030223
-4.304802
other
Mg4B16O64
84
14
1,234.55
mp-1100375
-3.423279
-1.636489
-5.662715
other
Ca12Sn12S36
60
14
1,790.76
mp-3735
13.483402
5.30658
-6.460661
other
Gd4P4O16
24
14
277.63
mp-1095634
-6.169798
-2.496189
-0.132829
other
Te4As4Ru4
12
14
239.26
mp-759879
15.13836
12.329558
-1.026962
other
V24O20F32
76
14
786.77
mp-1373332
8.797222
1.768881
0.923762
other
Mg4Sb4F20
28
14
402.35
mp-582606
8.032269
8.679852
-0.285356
other
Eu16Al8O36
60
14
864.47
mp-1189736
6.53389
11.45625
0.657371
other
Er4Ni4O12
20
14
213.89
mp-769580
14.40137
9.07461
-2.864583
other
V6P4O16
26
14
355.86
mp-866941
-3.417567
-1.653753
-5.629372
other
Ca4Sn4S12
20
14
550.31
mp-541745
-3.413716
-0.717906
-4.873959
other
Rb12Nb8S44
64
14
1,818.67
mp-1373532
8.631577
1.569823
1.198321
other
Ca4Sn4F20
28
14
488.94
mp-849461
8.374913
10.762489
-0.142851
other
Na12Mn4O12
28
14
399.46
mp-1247255
1.653028
1.952576
2.204823
other
Nb6In2N12
20
14
245.31
mp-762058
10.75302
11.595309
2.40745
other
Na16Ti16O40
72
14
1,163.17
mp-17473
-4.698929
-5.086412
0.300224
other
Na16Al16As24
56
14
1,268.11
mp-1203318
7.666775
7.335099
-4.264214
other
La4Se8O36
48
14
839.97
mp-1191389
10.984257
12.25845
-3.668956
other
Pr4V4O16
24
14
324.76
mp-542219
8.959397
1.329117
1.185883
other
Li8Zr4F24
36
14
375.98
mp-1208410
11.328921
11.035627
-4.168352
other
Tb4Mo4O20
28
14
423.79
mp-1016146
8.504492
14.744423
-1.231552
other
Mg4Mn16O32
52
14
603.65
mp-22420
9.334201
10.682179
-2.148005
other
Cu4Te4O16
24
14
268.18
mp-1043813
6.639651
9.106871
-1.19834
other
Zn4Bi8O20
32
14
536.84
mp-1212791
4.643763
3.515357
-3.892047
other
P16N48O8
72
14
1,833.44
mp-1200143
4.617558
3.108152
-3.962968
other
Pd4S16N16
36
14
957.93
mp-9457
9.807405
10.896811
1.072883
other
Ca6Re2O12
20
14
257.98
mp-768870
6.639634
5.862354
-3.560515
other
Ca4Cl8O24
36
14
514.71
mp-1225760
-0.961226
1.055052
-1.66305
other
Dy16C8I24
48
14
1,691.37
mp-1044399
10.135656
7.956982
-2.868782
other
Mn4Ge8O24
36
14
464.21
mp-760120
9.400645
1.129628
-0.336429
other
Cu24O16F16
56
14
652.73
mp-1208398
8.162498
7.293862
-3.878661
other
Tl8Se12O48
68
14
1,120.2
mp-561817
12.821058
7.668613
-6.416235
other
Co6P4O16
26
14
285.96
mp-1199261
9.223699
7.545937
-2.496032
other
K8Si8O24
40
14
671.45
mp-1189843
-5.858078
-1.453591
4.204005
other
Np4Tc6Ge8
18
14
310.56
mp-1200045
6.381017
5.60866
-4.472259
other
Bi24N20O104
148
14
2,281.54
mp-560083
8.454877
14.690604
-0.708067
other
Ca8Mn24O48
80
14
913.02
mp-1210328
7.300098
8.070981
-3.460075
other
Ni2P4O20
26
14
352.72
mp-555131
8.424245
3.683585
-6.611042
other
Cs8C8O16
32
14
615.56
mp-772141
-1.231483
1.867659
-1.557853
other
Ba8La4I28
40
14
1,753.14
mp-1198635
6.892432
6.108331
-3.821886
other
K4Te4O28
36
14
757.62
mp-5279
9.731341
9.255778
0.030856
other
Ca6Te2O12
20
14
260.39
mp-19144
10.964649
11.193088
-2.184031
other
Rb4W4O14
22
14
340.7
mp-755662
12.867974
-0.881501
0.354043
other
Mn8O8F8
24
14
271.62
mp-766301
-1.246345
1.908286
-1.624227
other
Ba8Ca4I24
36
14
1,718.85
mp-1196263
7.94499
6.97142
-4.17294
other
Mo8As8O48
64
14
1,115.44
mp-780342
10.351957
9.44075
3.690624
other
Gd8Zr8O28
44
14
631.4
mp-29095
10.301556
4.312749
-5.043699
other
H16S4O20
40
14
377.29
mp-770389
9.898113
4.973548
-7.153619
other
V8S12O48
68
14
883.24
mp-553909
8.543015
7.328454
-3.707718
other
Tl8Se12O36
56
14
888.6
mp-17817
-3.575981
-4.348768
0.614413
other
Ca12Ge8P16
36
14
818.61
mp-766954
9.848795
2.153535
0.486997
other
Li4V4F20
28
14
377.75
mp-772920
11.16899
11.870219
0.473516
other
Li32Ti8O28
68
14
706.8
mp-1209012
9.743117
10.781951
-3.137611
other
Sm4W4O20
28
14
445.9
mp-572903
9.130994
0.402209
0.401155
other
Cs4Cu8F20
32
14
489.74
mp-781976
9.595642
0.515415
-0.349743
other
Li8Cu4F20
32
14
356.35
mp-1105728
-3.331067
-4.337752
0.702661
other
Ba4Ga8P8
20
14
491.73
mp-1209404
6.28826
5.505225
-4.445168
other
Th4N12O56
72
14
1,475.5
mp-1226064
-5.583317
-0.86012
-3.933979
other
Co2Ni2S8
12
14
172.85
mp-781707
10.464837
8.313759
2.368071
other
La16Al8O36
60
14
939.88