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-1208288
-6.641663
-3.414416
5.884154
other
U12Ta8Al86
106
193
1,886.58
mp-1219438
-5.419277
-2.48736
4.816029
other
Sc4V6Si6
16
193
256.38
mp-30644
-6.087847
-3.162074
4.133581
original
Hf6Nb4Ga6
16
193
294.15
mp-1207408
-5.180405
-3.312548
4.201083
other
Zr10Si6N2
18
193
305
mp-1210658
-7.731697
-6.579515
5.797637
other
Lu10Cu2Pb6
18
193
468.08
mp-1211768
-6.807014
-5.276399
5.63415
other
La10Cu2Ge6
18
193
505.6
mp-1105327
-5.883096
-0.581049
3.86861
other
Cr10Si6C2
18
193
200.45
mp-1213800
-5.87686
-4.501717
1.253496
other
Ce6Zr2Sb10
18
193
502.42
mp-1209147
-6.674046
-3.694817
6.365793
other
Sm12Ti8Al86
106
193
1,890.85
mp-569606
-6.592018
-5.437001
1.954053
other
Nd6Mn2Bi10
18
193
528.19
mp-1205406
-5.831621
-3.952969
1.143426
other
U6V2Sb10
18
193
437.45
mp-20784
-4.064074
-0.105999
-3.67071
other
Ta6Pb2S12
20
193
436.72
mp-1188640
-5.87607
-3.691221
3.342179
other
Zr10Sn6As2
18
193
387.45
mp-983061
11.479014
7.841084
-3.848522
other
Sr2As4O12
18
193
224.33
mp-31207
-5.971632
-3.803935
3.526074
other
Zr10Ga2Sn6
18
193
385.96
mp-1208616
-6.668182
-2.509458
6.386135
other
Tb12Al78Cr16
106
193
1,788.08
mp-1210286
12.105163
10.601732
0.333037
other
Na8Re4O12
24
193
322.33
mp-13243
-5.663725
-3.912832
1.192027
other
Sc2U6Sb10
18
193
473.63
mp-21852
-3.957874
-0.114948
-3.78866
other
Nb6Pb2S12
20
193
443.11
mp-1209778
-6.205671
-4.830329
1.812084
other
Pr6Hf2Sb10
18
193
506.51
mp-1210971
-6.652126
-3.608284
6.378205
other
Lu12Nb8Al86
106
193
1,881.87
mp-1208517
-5.719121
-3.20209
3.556818
other
Ti10Fe2Sn6
18
193
324.09
mp-1223328
-6.994874
-4.913155
5.667094
other
La4Er6Ge6
16
193
431.13
mp-1213290
-7.542645
-6.601735
5.86719
other
Dy10Cu2Pb6
18
193
481.59
mp-1207841
-6.09828
-0.937844
3.783905
other
V10Si6N2
18
193
212.95
mp-567554
-7.276993
-2.278193
6.355514
other
Ce8Al60Ru12
80
193
1,350.68
mp-1208239
-5.802013
-3.255349
3.470064
other
Ti10Cu2Sn6
18
193
321.8
mp-21227
-5.831823
-3.994828
1.315007
other
U6Ti2Sb10
18
193
460.76
mp-1106165
-5.411803
-2.46752
3.854847
other
Nb10Si6B2
18
193
268.68
mp-1208865
-6.211677
-4.854299
1.883777
other
Sm6Zr2Sb10
18
193
488.7
mp-1203633
-6.612732
-3.117386
6.396078
other
Sm12Al86Cr8
106
193
1,851.05
mp-1213242
-6.631668
-3.031559
6.454839
other
Dy12Al86V8
106
193
1,853.1
mp-1188561
-6.605667
-5.647542
3.414142
other
Pr10Cu2Bi6
18
193
540.83
mp-1208220
-5.980209
-3.435736
3.477312
other
Ti10Sn6Au2
18
193
339.08
mp-641069
-7.392689
-6.697269
6.048666
other
Pr10Ni2Pb6
18
193
534.8
mp-1190264
-7.150311
-5.817942
4.246477
other
Ce10Cu2Sn6
18
193
501.74
mp-1209345
-7.500755
-6.4851
5.064699
other
Pr10Ag2Sn6
18
193
549.59
mp-1212353
-6.775435
-2.724913
6.476257
other
Ho12Al86Mo8
106
193
1,861.07
mp-1189075
-5.337031
-3.438674
2.234316
other
Zr10Ge2Sb6
18
193
381.84
mp-1214183
-6.601021
-2.717711
6.445403
other
Ca12Al86W8
106
193
1,858.32
mp-1202005
-6.803098
-2.763143
6.484869
other
Lu12Al86Mo8
106
193
1,840.35
mp-1213481
-6.730963
-2.82224
6.453987
other
Er12Mn8Al86
106
193
1,820.36
mp-1106340
-6.952731
-6.402725
5.130852
other
La10Mn2Pb6
18
193
586.66
mp-1188578
-7.017946
-6.523149
5.152181
other
La10Cu2Pb6
18
193
587.89
mp-1212187
-6.156118
-3.230391
4.168847
other
Hf6Ti4Ga6
16
193
289.04
mp-9333
-6.163298
-4.756535
1.652541
other
La6Ti2Sb10
18
193
505.59
mp-1209928
-4.91106
-4.690973
6.268673
other
Nd10Si6B2
18
193
458.07
mp-1213274
-6.46314
-3.560606
6.281414
other
Dy12Ta8Al86
106
193
1,866.52
mp-1215386
-5.319857
-3.13391
4.293358
other
Zr6Ti4Si6
16
193
280.31
mp-1369222
8.484435
13.231406
-1.335587
other
Mn4Nb4O18
26
193
305.99
mp-1207413
-5.827423
-3.88666
3.437078
other
Zr10Sn6C2
18
193
364.21
mp-1189002
-4.93885
-4.700494
6.16855
other
Nd10Si6C2
18
193
448.85
mp-1207930
-6.67382
-4.460557
3.384943
other
U6Ti2Sn10
18
193
438.06
mp-1208623
-6.686614
-2.598372
6.253317
other
Tb12Al78V16
106
193
1,841.25
mp-1189755
-6.592672
-5.563918
3.439957
other
Nd10Cu2Bi6
18
193
529.52
mp-1190397
-6.025149
-3.865733
3.786883
other
Zr10In6Ag2
18
193
396.75
mp-1106398
-6.036767
-0.900734
3.498677
other
V10Ge6B2
18
193
226.99
mp-1212526
-6.120881
-3.738089
3.63626
other
Hf10Co2Sn6
18
193
364.55
mp-1189510
-5.840014
-3.594012
3.38593
other
Zr10Sn6S2
18
193
379.8
mp-9435
-6.048453
-4.735059
1.52721
other
La6Zr2Sb10
18
193
521.08
mp-1190137
-7.032609
-5.858103
4.2296
other
Tb10Cu2Bi6
18
193
484.84
mp-1211573
-7.081193
-6.411847
5.418685
original
La10Pb6C2
18
193
561.87
mp-1208348
-5.451286
-2.010364
3.5992
other
Ta10Ga6B2
18
193
275.28
mp-1210041
-6.024568
-2.654744
4.689051
other
Nb12Al22Ir2
36
193
571.18
mp-1211687
-7.173964
-5.685575
5.407546
other
La10Ge6O2
18
193
470.91
mp-1208191
-6.650789
-3.656868
6.405912
other
Tm12Ti8Al86
106
193
1,869.28
mp-1208323
-5.209709
-3.217396
2.748029
other
Ti10Cu2Bi6
18
193
337.18
mp-755486
10.034486
9.446636
0.336129
other
Na8Sn4O12
24
193
289.3
mp-568964
-6.400046
-5.511024
1.717096
other
La6Mg2Bi10
18
193
557.47
mp-1213257
-6.623951
-3.505199
6.411888
other
Dy12Nb8Al86
106
193
1,871.98
mp-1190391
-5.599167
-3.703836
3.623568
other
Zr10In2Pb6
18
193
413.48
mp-1208445
-7.513948
-6.582095
5.845642
other
Tb10Cu2Pb6
18
193
489.12
mp-1200512
-6.683295
-2.642732
6.420798
other
Er12Al86W8
106
193
1,858.94
mp-1188693
-5.446349
-3.430862
2.448429
original
Hf10Ni2Sb6
18
193
357.66
mp-30211
-7.235533
-6.284094
4.733691
other
La10Sn6I2
18
193
594.45
mp-17875
1.855175
1.758934
1.395172
other
Ca12Ga2N10
24
193
418.42
mp-680754
-6.014587
-7.163156
3.424039
other
Ca10Cu2Pb6
18
193
543.61
mp-1189871
-5.917141
-3.628368
3.461753
other
Zr10Sn6N2
18
193
357.55
mp-542804
-7.059323
-6.470945
5.183046
other
La10Ni2Pb6
18
193
580.12
mp-16916
1.592255
1.750564
1.357571
other
Ca12Fe2N10
24
193
409.51
mp-639263
-6.231771
-5.047249
1.518663
other
Ce6Mn2Bi10
18
193
493.24
mp-1189066
-5.084123
-4.325377
6.253132
other
Y10Si6H2
18
193
388.63
mp-1189342
-5.407788
-3.50957
3.297141
original
Zr10Te2Pb6
18
193
419.04
mp-995201
-5.174475
-2.662627
4.182601
other
Ti10Si6C2
18
193
248.09
mp-29684
-6.243872
-5.029532
2.363282
other
La10Sb6Br2
18
193
552.23
mp-9407
-3.914252
-0.13352
-3.855858
original
Nb6Sn2S12
20
193
428.75
mp-30676
-6.104343
-3.230425
4.009045
other
Zr6Ti4Ga6
16
193
298.94
mp-1210336
-6.607557
-3.582416
6.331119
other
Nd12Nb8Al86
106
193
1,929
mp-1211294
-5.983958
-4.689737
1.40748
other
La6Nb2Sb10
18
193
505.54
mp-1208824
-6.655631
-3.688684
6.331487
other
Sm12Nb8Al86
106
193
1,940.53
mp-1213244
-5.032688
-4.469556
6.138599
other
Er10Si6B2
18
193
387.79
mp-1105818
-5.592236
-2.167806
3.411793
other
Nb10Ge6B2
18
193
279.34
mp-18539
11.40736
11.274964
-2.364214
other
Rb2W6O18
26
193
374.17
mp-569350
-7.327957
-6.243624
4.876507
other
La10Sn6Br2
18
193
574
mp-1207755
-6.530098
-3.635715
6.243071
other
Yb12Nb8Al86
106
193
1,939.13
mp-1213881
-5.890808
-4.497696
1.282887
other
Ce6Hf2Sb10
18
193
500.11
mp-977347
-5.900393
-3.22077
4.459093
other
Hf10Al6N2
18
193
321.14
mp-1211722
-6.913292
-5.313624
5.6696
original
La10Ni2Ge6
18
193
505.9
mp-1106117
-7.084967
-6.528707
5.109343
other
La10Ag2Pb6
18
193
586.43
mp-1106401
-7.08058
-6.232517
4.679349
other
Ce10Ag2Pb6
18
193
549.28