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-1239078
-5.807042
-5.993578
1.847114
other
Ho8Bi16C8
32
135
822.6
mp-1195122
2.121372
2.78704
-4.48481
other
V12Sb8Cl96
116
135
3,614.39
mp-8804
1.36585
2.506205
1.66826
other
Li12Mo2N8
22
137
213.59
mp-756155
9.995773
12.192669
0.234047
other
Li24Fe4O16
44
137
417.92
mp-752976
11.069421
0.849391
1.867042
other
Mn8O2F12
22
137
278.07
mp-1106347
-9.412773
-0.476167
4.431624
other
Th2B8Rh8
18
137
221.64
mp-1105964
-7.581565
0.861147
3.912298
other
Y2Co8B8
18
137
174.42
mp-1247058
2.198032
2.197024
1.27502
other
Li12Te2N8
22
137
230.3
mp-37722
5.326162
-0.377331
-2.986369
other
K2B2H8
12
137
142.85
mp-1029542
1.579445
2.340949
1.220521
other
Na12Mo2N8
22
137
329.05
mp-768810
0.00622
1.017283
-3.718025
other
Sr8Br12O2
22
137
698.96
mp-1246724
1.964429
2.237582
1.16406
other
K12W2N8
22
137
459
mp-1029739
1.653486
2.535246
1.09231
other
Li12Fe2N8
22
137
205.59
mp-1106078
-9.399541
-0.414474
4.482523
other
Gd2B8Rh8
18
137
214.22
mp-1247444
-0.074085
2.258762
2.179675
other
Co12W2N8
22
137
221.57
mp-1245465
1.793545
2.265222
0.96875
other
Rb12Mo2N8
22
137
527.71
mp-1106048
-9.266701
-0.415619
4.376218
other
Ce2B8Rh8
18
137
215.02
mp-770533
9.971637
12.045589
0.24956
other
Li24Mn4O16
44
137
397.82
mp-1246277
1.732687
2.15814
1.30193
other
Na12Re2N8
22
137
351.13
mp-8408
-9.426706
-0.385717
4.483469
other
Er2B8Rh8
18
137
212.01
mp-646110
-8.051386
-6.517365
6.455687
other
Y56In12Rh12
80
137
2,227.37
mp-1029726
1.601852
2.319025
1.252792
other
Li12Ir2N8
22
137
221.92
mp-22165
-7.650551
0.817668
3.836131
other
Ce2Co8B8
18
137
178.92
mp-540785
8.15276
2.427706
-1.242836
other
P8C8F24
40
137
822.09
mp-28855
9.147341
1.305066
0.964711
other
Cd8O2F12
22
137
307.09
mp-1029826
1.550806
2.291502
1.407323
other
Li12Os2N8
22
137
213.25
mp-760829
8.116983
10.554674
-0.360078
other
Na8Cu16O16
40
137
466.43
mp-1029656
1.580647
2.380718
1.248704
other
Na12W2N8
22
137
329.85
mp-567143
-8.290835
-6.482937
6.423785
other
Lu56In12Co12
80
137
1,986.24
mp-1194770
-5.802434
-3.303212
-1.847158
other
K14Fe8Te16
38
137
1,301.61
mp-2646948
5.263397
-0.500717
-3.027555
other
Yb8B8H32
48
137
575.62
mp-1246396
1.752353
2.331616
0.878763
other
Rb12Re2N8
22
137
581.49
mp-27274
8.041106
2.618897
-2.155131
other
As8C8F24
40
137
744.61
mp-1202253
-8.122416
-1.818546
2.987741
other
Eu8Si12Ni32
52
137
747.06
mp-675623
6.674586
5.800673
-3.319768
other
Cs2Cl2O8
12
137
201.58
mp-36063
-5.021949
-4.83106
0.621042
other
Li14Mn2As8
24
137
444.91
mp-1105740
-9.508523
-0.434591
4.450487
other
Dy2B8Rh8
18
137
213
mp-1189784
-9.447484
-0.448992
4.43506
other
Ho2B8Rh8
18
137
211.79
mp-1247242
2.188598
2.234092
1.070497
other
Li12S2N8
22
137
194.28
mp-1247453
1.726028
2.193384
1.010851
other
Na12Ru2N8
22
137
335.22
mp-760327
8.968662
9.830438
0.021045
other
Na24Ni4O16
44
137
613.55
mp-27483
8.211371
11.706794
-0.457405
other
Li40Tl8O32
80
137
816.37
mp-978569
-9.454158
-0.378791
4.419543
other
Sm2B8Rh8
18
137
212.33
mp-1245607
2.145742
2.169747
0.995818
other
Na12Te2N8
22
137
341.32
mp-755084
9.509265
9.069561
0.390341
other
Na12Mg2O8
22
137
293.11
mp-1185179
9.212638
12.289178
0.10925
other
Li20Co8O18
46
137
420.43
mp-1189538
-7.615849
0.84241
3.881423
other
Lu2Co8B8
18
137
171.55
mp-752856
-4.682596
-1.055517
-5.42325
other
Li20Fe8S18
46
137
789.48
mp-27355
8.48315
1.685792
0.767454
other
Pb8O4F8
20
137
385.64
mp-1189046
-9.039034
-0.782963
4.128162
other
Er2B8Ir8
18
137
214.39
mp-1190291
-7.580805
0.842922
3.901968
other
Tm2Co8B8
18
137
173.95
mp-766521
-4.408848
-1.379956
-5.820649
other
Li20Cu8S18
46
137
760.4
mp-780241
9.305791
8.707105
0.475666
other
Na40Gd8O32
80
137
1,261.94
mp-1444146
6.634475
5.793562
-3.322109
other
Rb2Cl2O8
12
137
205.98
mp-753683
9.073972
3.071954
1.361483
other
Sn8O4F8
20
137
365.05
mp-755322
9.310252
9.170329
0.280799
other
Ba2Na12O8
22
137
361.88
mp-1106361
-5.083284
0.155203
3.436209
other
La2Re8B8
18
137
228.65
mp-753717
9.489389
0.70449
-0.660553
other
Cu8O2F12
22
137
242.42
mp-1181496
-7.658209
0.826577
3.884485
other
Gd2Co8B8
18
137
176.1
mp-1246661
2.138827
2.318946
0.977645
other
Na12S2N8
22
137
297.97
mp-5984
-9.489908
-0.45089
4.445412
other
Y2B8Rh8
18
137
213.6
mp-760635
-0.458791
0.934971
-4.243841
other
Yb8Br12O2
22
137
586.17
mp-780217
9.416569
12.086311
-0.024272
other
Li14Cu2O8
24
137
211.54
mp-770528
8.851657
12.665803
-0.146773
other
Li40Mn8O32
80
137
770.84
mp-1013726
8.930251
1.442914
1.258424
other
Cd8S2F12
22
137
343.13
mp-553966
8.122602
11.269252
-0.288967
other
Li8Cu16O16
40
137
398.34
mp-1180013
3.215763
3.2439
-3.93103
other
Pd10N36Cl20
66
137
1,531.99
mp-1246324
1.83118
2.319836
0.676948
other
Cs12Mo2N8
22
137
635.81
mp-1178924
-9.053204
-0.840115
4.183239
other
Tm2B8Ir8
18
137
213.92
mp-557093
7.719279
9.928827
-3.787339
other
Sr8Cr16O56
80
137
1,193.08
mp-1190025
-3.241333
-1.51482
-4.922913
other
Ba4U2S12
18
137
477.51
mp-772552
10.437618
12.129393
0.319664
other
Li12Cr2O8
22
137
212.23
mp-582259
1.630682
2.366375
1.536089
other
Li14V2N8
24
137
224.88
mp-984550
3.447827
-0.592724
-2.697273
other
Cs2Ga2H8
12
137
240.72
mp-3297
9.752915
11.378763
0.320651
other
Li20Zn8O18
46
137
431.46
mp-684000
-8.118617
-1.843753
2.97659
other
Eu8Si12Ni32
52
137
770.02
mp-753762
10.670871
2.101566
2.42299
other
Fe8O2F12
22
137
260.96
mp-753915
9.931849
2.625594
1.897515
other
Cr8O2F12
22
137
277.45
mp-757177
-4.136895
-1.350357
-5.717947
other
Li12Cu2S8
22
137
362.59
mp-1185196
8.857718
12.229221
-0.095584
other
Li20Ni8O18
46
137
450.72
mp-768986
9.867672
11.058852
0.104287
other
Li40Bi8O32
80
137
909.73
mp-752512
8.702557
12.250344
-0.314169
other
Li12Cu2O8
22
137
201.94
mp-1188833
-5.096591
0.262203
3.412568
other
Y2Re8B8
18
137
222.04
mp-1245841
1.90969
2.225482
1.123276
other
K12Mo2N8
22
137
458.04
mp-1106036
-7.584336
0.865662
3.868945
other
Tb2Co8B8
18
137
174.49
mp-1196622
8.061208
5.610246
-5.49586
other
Yb8C8O32
48
137
752.25
mp-18925
9.241027
12.212379
-0.035493
other
Li24Co4O16
44
137
386.23
mp-1030649
1.599381
2.329822
1.276941
other
Li12Ru2N8
22
137
219.57
mp-1189595
-7.655063
0.898104
3.896684
other
Dy2Co8B8
18
137
174.64
mp-1188110
-9.366827
-0.486508
4.480111
other
Lu2B8Rh8
18
137
210.46
mp-755280
9.463123
9.832441
0.137937
other
Na24Fe4O16
44
137
624.4
mp-760125
8.947848
9.797983
0.062785
other
Na24Co4O16
44
137
612.62
mp-780259
9.695777
11.012931
0.694704
other
Li40La8O32
80
137
931.67
mp-776255
-3.72183
-1.342823
-5.50893
other
Li40Sb8S32
80
137
1,616.54
mp-1188650
-7.671374
0.855465
3.890217
other
Ho2Co8B8
18
137
174.55
mp-1246483
1.577808
2.282914
1.562492
other
Li12Re2N8
22
137
221.59
mp-973480
-9.456157
-0.39641
4.456216
other
Nd2B8Rh8
18
137
218.24
mp-1178012
-4.432098
-1.484704
-5.838977
other
Li8Cu4S8
20
137
365.01
mp-38725
5.327937
-0.493768
-2.983062
other
Na2B2H8
12
137
106.04
mp-754210
-4.260097
-1.26829
-5.528853
other
Li12Fe2S8
22
137
370.6