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-20615
-7.603653
-5.564166
3.358389
other
Eu4Ge4Pd4
12
14
265.62
mp-1196072
1.241892
2.116856
-5.664844
other
K12Sc4Cl24
40
14
1,124.63
mp-1201979
6.25655
5.418234
-4.406822
other
Nd4N12O52
68
14
1,128.66
mp-1199200
8.382602
4.425574
-6.894472
other
Fe8C4O20
32
14
320.9
mp-1210723
13.920833
7.728159
-6.44223
other
Mn8P8O24
40
14
587.5
mp-770464
6.108317
8.810676
-1.203258
other
La4Bi4O16
24
14
381.59
mp-1203214
7.291874
8.023713
-3.437244
other
Mg8P4O32
44
14
555.09
mp-1105923
-5.635644
-2.056701
4.354899
other
Ho4Si8Mo6
18
14
298.72
mp-1202492
9.468075
8.309948
-0.185039
other
Cs40Ge8O36
84
14
2,362.11
mp-1191910
6.157637
5.714006
-4.367053
other
Ni2N4O16
22
14
291.7
mp-560863
9.13169
6.851599
-3.747546
other
Th4Se8O28
40
14
597.02
mp-753963
11.798731
12.743977
-0.405202
other
Cr4O4F4
12
14
132.56
mp-1180377
10.680984
10.103131
-5.734588
other
Mn14P4O32
50
14
608.61
mp-1211439
8.015896
7.856395
-4.155844
other
K4P4O16
24
14
423.43
mp-556442
8.202382
2.613106
-1.176807
other
Tc8O20F16
44
14
633.32
mp-1198859
-1.351654
2.31862
-4.9058
other
Bi4W12Br36
52
14
1,706.87
mp-1172466
15.191455
5.616649
-0.348092
other
He8Si8O16
32
14
403.4
mp-756313
-1.037135
2.250131
-2.823262
other
Ca4Pb4I16
24
14
1,207.89
mp-1245541
1.408585
2.162014
2.170382
other
Fe4Si4N8
16
14
152.68
mp-31818
8.701653
7.918731
-4.755126
other
Fe6P8O32
46
14
633.8
mp-558224
10.526331
9.391273
-1.77102
other
Dy16Te24O72
112
14
1,708.39
mp-560613
9.7747
9.559233
-1.754977
other
Na16Te8O32
56
14
730.37
mp-1047798
10.665576
10.90487
-3.841533
other
Cu8Mo8O32
48
14
722.12
mp-30297
9.52871
2.129319
1.464493
other
Sr8V8F40
56
14
748.5
mp-28542
1.216341
1.818724
-5.394971
other
Na6Er2Cl12
20
14
492.74
mp-755490
5.956369
10.862732
-1.445483
other
Na8Fe4O12
24
14
320.16
mp-504985
-7.749133
-4.244171
3.273523
other
Ba4Ga8Pt8
20
14
461
mp-775265
10.408508
0.844545
1.670891
other
Li8Mn12F32
52
14
746.35
mp-1043032
11.723876
7.455934
-1.031158
other
Ti4Ge8O24
36
14
487.48
mp-766217
7.100476
10.256725
1.27872
other
Sr8Cu4O14
26
14
360.86
mp-672986
12.73293
6.710374
-6.603664
other
Sn4P4O16
24
14
409.94
mp-760144
9.046874
2.995655
-0.080704
other
W8O8F32
48
14
811.48
mp-861261
7.643219
10.089658
-3.803954
other
Cr12Co8O48
68
14
981.95
mp-28669
8.450422
7.388743
-3.763319
other
Mn2Se4O12
18
14
248.86
mp-759873
10.64828
9.206793
-0.880013
other
Sb16O22F4
42
14
810.77
mp-27540
11.721772
4.182347
-3.797106
other
Al8H24O24
56
14
433.46
mp-8585
8.474092
1.841757
-0.73281
other
Pd2Au4F16
22
14
312.18
mp-1102288
-6.564878
-2.416729
-0.032267
other
Fe4Te4As4
12
14
214.61
mp-700146
12.930513
10.493263
-0.035852
other
Nd10Mo64O108
182
14
2,564.55
mp-1203184
8.093708
7.286378
-4.723047
other
V4P4O28
36
14
537.09
mp-1182734
8.197865
9.108854
-3.840039
other
Li16Re16O88
120
14
2,238.73
mp-1245626
2.454459
1.93193
1.806925
other
Y4Al4N8
16
14
215.95
mp-4841
-3.281302
-2.216221
-5.732737
other
La4Cu4S8
16
14
330.77
mp-759032
10.452982
0.878502
1.58247
other
Li8Mn8F24
40
14
503.14
mp-29053
12.91208
10.459406
-0.164155
other
K6Mo28O44
78
14
1,181.33
mp-776648
10.119551
1.735705
2.036084
other
Li4Fe6F16
26
14
392.89
mp-16543
8.264871
9.355379
-0.347266
other
Cs12Cu20O16
48
14
1,104.29
mp-1105365
6.290375
4.955414
-4.482284
other
K4N4O12
20
14
342.96
mp-17160
8.43955
1.658765
-0.093753
other
Dy4Pt4F28
36
14
500.28
mp-17922
13.175403
5.548336
-6.405063
other
Ca8P8O28
44
14
572.05
mp-557882
-5.433743
-0.163655
-5.632072
other
Ba4Cr16S28
48
14
941.44
mp-1218792
11.236643
8.880413
2.36554
other
Sr16U8O36
60
14
982.12
mp-1182302
13.074976
6.694431
-0.639324
other
Mg8Si8O24
40
14
499.1
mp-1194798
9.492137
6.991107
-3.781304
other
Sc8Se12O40
60
14
923.04
mp-780118
6.939039
11.289244
-0.873519
other
Na16Ni8O20
44
14
574.25
mp-1199914
9.273038
7.013
-3.309598
other
Mn8Se8O24
40
14
590.8
mp-1196705
5.353512
3.612774
-4.159834
other
S24N20O16
60
14
1,391.82
mp-19453
10.540101
9.630563
-2.379555
other
Te8Mo4O28
40
14
592.07
mp-1202969
-3.178007
0.39353
-3.472502
other
Tc12Se16I4
32
14
850.42
mp-28673
13.580551
7.408352
-5.006683
other
P16S4O24
44
14
855.92
mp-4534
8.335627
3.698081
-6.276728
other
Na4C4O8
16
14
184.11
mp-22999
8.728572
8.473475
-1.668467
other
Hg6Cl4O4
14
14
293.44
mp-554824
7.869697
10.447404
1.865144
other
La12Ru4O28
44
14
611.58
mp-30222
-3.46693
-1.349918
-5.299606
other
Cs12B4S12
28
14
958.05
mp-754660
-5.032422
-0.826689
-4.960579
other
Li4Fe4S8
16
14
265.41
mp-559498
8.766225
8.541307
-0.040259
other
K36Bi20O52
108
14
2,284.82
mp-17291
-5.906541
-3.477163
-2.025971
other
Na12Si4Te12
28
14
892.34
mp-770720
10.043959
11.596495
0.820218
other
Li16Zr4O16
36
14
405.42
mp-1201130
10.645664
11.458625
3.235746
other
Eu4Nb8O24
36
14
492.58
mp-630329
9.432707
7.174492
-3.112737
other
Pb8Se8O24
40
14
638.57
mp-17102
7.748465
10.380893
0.858875
other
Ba8Ir6O20
34
14
517.99
mp-1211645
8.234843
0.925381
1.715023
other
K6Tm2F12
20
14
360.31
mp-7651
12.2005
6.646804
0.355139
other
Th4Si4O16
24
14
296.36
mp-510464
7.597353
6.525537
-3.027188
other
Ce4I12O36
52
14
840.52
mp-1194462
7.575363
7.411609
-4.107058
other
Zn4Se4O20
28
14
378.87
mp-756898
10.587893
10.533412
3.335004
other
Tm4Ta4O16
24
14
290.04
mp-768385
-0.138115
0.781059
-3.770971
other
Ba8Y4Br28
40
14
1,756.91
mp-1372453
9.842346
2.173855
1.458217
other
Mg4V4F20
28
14
359.95
mp-561139
8.485596
9.427553
-0.197884
other
Rb16Fe4O14
34
14
733.96
mp-22983
1.701908
2.321009
-5.198185
other
Li4Al4Cl16
24
14
585.74
mp-9726
8.860106
1.092019
1.483127
other
Sr4Be4F16
24
14
296.77
mp-1247246
2.122108
2.045405
1.306711
other
Sr4Sn4N8
16
14
304.75
mp-1047152
9.009322
10.19848
-3.301765
other
Ir2W2O12
16
14
209.62
mp-768940
9.581177
5.188617
-6.907389
other
Cr8S12O48
68
14
837.71
mp-1210931
1.725235
2.641899
-5.026871
other
Li4Fe4Cl16
24
14
584.85
mp-29975
-3.342022
-1.304475
-5.483291
other
K12B4S12
28
14
741.38
mp-769246
10.149595
10.348633
3.496765
other
Sr16Ta8O36
60
14
882.26
mp-1290304
5.716394
11.094248
-1.773623
other
Cd4Fe4O12
20
14
227.15
mp-1405246
9.128142
10.829284
-3.279624
other
Cr2W2O12
16
14
190.62
mp-1348431
9.260897
2.12127
1.510215
other
Mg4Mo4F20
28
14
405.94
mp-4988
-3.400749
-1.254591
-5.290348
other
Tl8As8S16
32
14
866.69
mp-1195826
13.360238
5.981941
-6.484714
other
Mg8P8O28
44
14
475.53
mp-777485
10.32282
0.898955
1.551038
other
Li8Mn4F16
28
14
335.53
mp-1029878
1.017454
2.309692
1.620232
other
Sr4Mn4N8
16
14
233.42
mp-29162
12.967881
10.70005
2.314288
other
Na2Nb20O36
58
14
725.66
mp-650442
-5.88975
-3.947404
-2.296756
other
Tl12Ag4Te8
24
14
764.5
mp-1024052
-4.823645
-3.110548
-3.997604
other
Na8Zn4Se8
20
14
477.32
mp-1203877
7.359694
6.979201
-4.37207
other
Zr4S4O36
44
14
638.8
mp-760332
10.912455
8.829229
-1.258748
other
Sb24O20F32
76
14
1,286.31
mp-705744
11.337687
12.512298
-0.534988
other
Fe20Si4O32
56
14
615.93