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-24066
10.042322
3.48194
-3.695541
other
Sr2H2Cl2O2
8
186
152.71
mp-6709
13.541906
4.686204
-1.420817
other
Ca6La6B10O30
52
186
627.65
mp-1228027
7.531161
11.208532
0.793001
other
Ba6Co4W2O18
30
186
426.3
mp-760345
8.355862
13.807015
-0.795003
other
Li6Ti2Fe6O16
30
186
291.72
mp-756292
6.143247
13.071988
-1.644017
other
Li4Fe6Co2O16
28
186
283.02
mp-582774
-3.520859
-4.04953
-3.50679
other
Ce8Mn2Se12O2
24
186
571.72
mp-777682
12.732707
12.738772
-0.389769
other
Li4Nb2V6O16
28
186
305.67
mp-772095
5.765563
12.738307
-1.690303
other
Li4Fe2Ni6O16
28
186
254.63
mp-1048406
7.875997
11.16185
-0.531898
other
Ba2Y2Ni8O14
26
186
364.83
mp-768294
6.110227
12.669676
-1.530842
other
Li4Fe6Cu2O16
28
186
288.59
mp-1223152
12.382696
7.594869
0.603161
other
La2Mg2Al22O38
64
186
614.7
mp-775742
9.216562
13.09778
-0.918561
other
Li4Fe6Te2O16
28
186
311.18
mp-554018
12.542795
7.50099
0.480511
other
Mg6Be2Al16O32
56
186
526.82
mp-1048159
11.389948
8.98496
0.224585
other
Ba2Al2Sn8O14
26
186
455.64
mp-41095
-3.28826
-4.678477
0.813459
other
Na6Sr6Al2P8
22
186
570.61
mp-556157
11.451509
11.114097
-3.314673
other
Li2Tl6Mo4O16
28
186
529.2
mp-1190339
-5.15245
-5.982646
0.651793
other
Na6Ca6Al2Sb8
22
186
673.13
mp-1199939
5.1764
3.319457
-3.482115
other
Cd4C18Br14N6
42
186
942.66
mp-754601
12.66973
12.735179
-0.780419
other
Li4V6Te2O16
28
186
308.08
mp-579188
-3.525198
-4.025387
-3.481558
other
Ce8Fe2Se12O2
24
186
552.08
mp-754882
6.302278
13.13584
-1.423698
other
Li4Ni6Sn2O16
28
186
282.07
mp-6606
2.735526
2.246074
1.79794
other
Sr2Y2Si8N14
26
186
314.63
mp-760989
8.379157
14.981435
-0.826026
other
Li6Mn6Ni2O16
30
186
268.12
mp-752417
8.794207
14.670063
-1.075877
other
Li4Mn6Cr2O16
28
186
283.24
mp-1228400
7.59122
10.847347
1.22374
other
Ba6Fe2Ru4O18
30
186
414.15
mp-758202
11.34519
13.106479
0.071757
other
Li4Nb2Cr6O16
28
186
298.86
mp-568916
-5.955088
-3.508571
-2.096859
other
K12In2Te8Cl2
24
186
930.95
mp-1210275
-5.073197
-6.077085
0.644015
other
Na6Sr6Ga2Sb8
22
186
735.86
mp-20295
2.67067
2.273173
1.712351
other
Yb2Eu2Si8N14
26
186
312.31
mp-1211376
11.207495
11.181174
-2.673177
other
K2Li2W2O8
14
186
316.4
mp-760963
12.662119
12.331027
-0.162162
other
Li10V6Cr2O16
34
186
301.28
mp-773163
6.812777
13.030627
-1.264508
other
Li4Fe6Sn2O16
28
186
305.92
mp-770175
8.364588
14.840569
-0.998136
other
Li4Mn6Fe2O16
28
186
285.24
mp-1228231
5.836103
10.612024
0.071176
other
Ba6Ti2Fe4O18
30
186
407.71
mp-1173658
9.28127
7.529319
-2.922642
other
Na2Be8Sb2O14
26
186
267.78
mp-15572
-4.662133
-5.429894
0.557797
other
Na6Ca6Al2As8
22
186
562.34
mp-775011
8.862657
13.497363
-0.837713
other
Li4Nb2Fe6O16
28
186
306.63
mp-642725
10.327306
3.521866
-3.673876
other
Ca2H2Cl2O2
8
186
127.23
mp-1190394
-2.548604
-2.788676
-5.557716
other
Nd8Fe2S12O2
24
186
513.45
mp-1177782
8.263271
13.876872
-1.320018
other
Li4V2Fe6O16
28
186
293.22
mp-771704
10.793578
13.159004
-0.237735
other
Li4Cr6Sb2O16
28
186
297.44
mp-775110
10.607242
13.099152
1.12324
other
Li4Ti6Co2O16
28
186
298.64
mp-542883
2.642365
2.25955
1.705281
other
Sr2Yb2Si8N14
26
186
316.23
mp-1217606
9.374339
4.687692
-4.143763
other
Tb2H36Br6O36
80
186
819.46
mp-559256
-2.21427
-2.395805
-5.529293
other
La8S6N2Cl6
22
186
543.72
mp-555074
-3.43715
-1.174734
-5.53073
other
Hg6As2S8Br2
18
186
501.53
mp-1048164
10.724029
8.919177
0.857565
other
Ba2Y2Sn8O14
26
186
528.98
mp-1048397
7.7901
11.634604
-0.784725
other
Ba2Al2Ni8O14
26
186
315.12
mp-554364
12.476474
7.546724
0.493898
other
Mg4Be4Al16O32
56
186
508.66
mp-23797
8.80714
4.595033
-4.166191
other
Li2H12Cl2O14
30
186
290.12
mp-771953
6.837184
13.179005
-1.353089
other
Li4Nb2Ni6O16
28
186
288.16
mp-754984
9.201597
13.927009
-1.226277
other
Li4Cr6Cu2O16
28
186
278.53
mp-1210941
7.191953
8.648232
-1.790693
other
Li2Mg8Sn2O16
28
186
319.38
mp-17145
9.246991
9.391531
1.061724
other
Ba6Cu2Sb4O18
30
186
437.44
mp-561124
9.643797
6.97362
-3.47754
other
Ho6Se8O24F2
40
186
645.48
mp-559044
4.696563
2.742451
-3.661417
other
Cu2C2S2N2
8
186
139.87
mp-759722
10.03158
2.027997
-3.779669
other
Si2H16N4F12
34
186
293.88
mp-1048386
11.774391
10.637334
0.854802
other
Ba2Y2Cr8O14
26
186
389.23
mp-771895
7.706922
12.912289
-1.356762
other
Li4Ni6W2O16
28
186
287.08
mp-1211339
11.147676
11.162311
-3.79749
other
K2Li2Mo2O8
14
186
310.47
mp-759988
7.874968
14.41913
-0.911658
other
Li6Mn2Fe6O16
30
186
286.81
mp-559355
-3.484839
-1.243682
-5.585549
other
Hg6As2S8Cl2
18
186
482.64
mp-567014
10.977324
11.098396
-2.378787
other
Rb4Te2W6O24
36
186
596.21
mp-752436
12.60176
11.68918
1.59133
other
Li4Mn2Nb6O16
28
186
334.42
mp-1216448
9.353377
4.687449
-4.151266
other
Y2H36Br6O36
80
186
839.66
mp-774680
10.518173
13.088801
1.137298
other
Li8Ti12Ni4O32
56
186
592.83
mp-11670
2.719966
2.243124
1.798904
other
Ba2Y2Si8N14
26
186
321.03
mp-1223719
9.546085
7.068585
-3.316259
other
K4Co4Se6O18
32
186
483.89
mp-771964
10.911969
13.833746
-0.75514
other
Li4V2Cr6O16
28
186
284.37
mp-775796
12.702214
11.435742
1.690453
other
Li4Ti6Nb2O16
28
186
303.79
mp-1080747
11.132425
8.835638
3.212802
other
Sc2Al2C2O2
8
186
92.53
mp-562048
5.733218
3.285711
-4.61809
other
Co6Bi2C18O18
44
186
840.97
mp-1192681
10.112142
4.458929
-4.229784
other
Li2Tc2H12O14
30
186
315.24
mp-774668
11.85233
13.534452
-1.405528
other
Li4V6Fe2O16
28
186
281.71
mp-771146
8.885665
14.623372
-0.556079
other
Li4Ti2Mn6O16
28
186
269.72
mp-1214367
10.957603
11.042631
0.43398
other
Ba2Tb2Fe8O14
26
186
379.32
mp-1181372
5.832426
4.790998
-4.248248
other
Fe2Br2N6O6
16
186
335.42
mp-1215388
8.801234
1.620541
1.332844
other
Zr12Pb2O4F44
62
186
769.71
mp-1216487
9.063107
4.908578
-4.101586
other
Yb2H36Br6O36
80
186
880.42
mp-757558
7.447848
13.884529
-1.566944
other
Li4Nb2Co6O16
28
186
272.1
mp-1191097
-2.541051
-2.532005
-4.798981
other
Ce8S6N2Cl6
22
186
519.76
mp-774290
9.698777
14.167489
-0.926212
other
Li4Mn2Cr6O16
28
186
280.77
mp-1048359
11.553908
11.28541
0.165885
other
Ba2Al2Fe8O14
26
186
310.51
mp-775271
11.573314
12.782934
-0.165201
other
Li4Cr6W2O16
28
186
296.75
mp-771971
8.209251
14.514491
-1.237051
other
Li4Mn6Ni2O16
28
186
278.93
mp-1210921
6.725271
9.034796
-2.138639
other
Li2Zn8Sn2O16
28
186
315
mp-1048382
7.969141
12.411891
-0.84935
other
Ba2Al2Co8O14
26
186
316.91
mp-763933
8.032208
14.060668
-0.982308
other
Li6Cr2Fe6O16
30
186
288.28
mp-1202354
-6.37485
-2.255709
0.966853
other
Yb5Zr3Ni16As12
36
189
548.69
mp-559929
12.745635
9.78582
1.468366
other
Ba3Ta6Si4O23
36
189
556.04
mp-1195749
-6.375093
-2.126725
1.068197
other
Tm5Zr3Ni16As12
36
189
544.61
mp-1105310
-7.956685
-0.677883
3.914659
other
Ti3Cr3B6Ir6
18
189
203.84
mp-15248
13.851655
5.283741
-3.900775
other
K3Nb3B2O12
20
189
274.71
mp-559141
8.85011
0.846854
1.032301
other
Ba15Cu12Cl3F51
81
189
1,337.64
mp-1095560
2.991046
-0.190257
-1.556441
other
Zr3Al3Ni3H2
11
189
146.83
mp-1226329
-6.618001
-0.906877
2.58478
other
Cr3Fe3Si1As2
9
189
113.53
mp-1105133
-8.279943
-2.6865
3.663791
other
Ho3Si2Sn3Rh9
17
189
292.54
mp-561310
8.572571
3.682221
-7.282023
other
Na3Li3C3O9
18
189
208.9
mp-1198172
-6.434294
-2.112962
1.088904
other
Dy5Zr3Ni16As12
36
189
546.58
mp-1210216
7.56198
11.268412
0.074951
other
Na4Dy2Ir3O12
21
189
248.12