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-1186846
-6.796774
-6.282166
2.165288
other
Pt2Pb6
8
194
244.44
mp-1094169
-7.72613
-9.421483
6.504336
other
La2Mg6
8
194
219.4
mp-1186975
-5.782209
-4.805749
1.93999
other
Sc6Te2
8
194
178.9
mp-1188047
-6.715174
-6.527569
6.332939
other
Y6Pu2
8
194
246.14
mp-1249332
15.625838
5.639896
0.361186
other
Si36O72
108
194
2,290.82
mp-2406
-8.078819
-9.420996
4.654523
other
Mg20Pd8
28
194
527.36
mp-1250
-8.053547
-6.519669
6.006429
other
Lu4In2
6
194
156.17
mp-1199510
-9.273347
-1.470378
2.826629
other
Pr10Ni38
48
194
707.31
mp-1204970
-9.076852
-6.122851
4.334582
other
Yb26Zn116
142
194
2,504.93
mp-1078584
-7.23276
-0.849476
3.910901
other
Mn6Ga2
8
194
95.85
mp-999205
-2.600455
-0.119461
3.019895
other
Sc2C2
4
194
62.14
mp-1120767
1.257497
1.998083
-5.505012
other
Na6Cl6
12
194
284.08
mp-1187802
-7.380975
-6.034436
6.163717
other
Y6Ge2
8
194
208.38
mp-1183354
-4.76551
-7.37314
3.628422
other
Ba6Yb2
8
194
461.22
mp-1005760
-6.193826
-7.085707
2.116562
other
Tl6Os2
8
194
185.02
mp-1186500
-7.574717
-7.177051
6.83971
other
Pm6Au2
8
194
222.77
mp-1187126
-5.031568
-7.516332
3.582819
other
Sr6Li2
8
194
376.05
mp-13854
-8.342108
-0.172747
4.852162
other
B6Ru4
10
194
93.73
mp-1184638
-6.946956
-4.309689
6.439715
other
Ho2Al6
8
194
152.94
mp-1183648
-7.917233
-6.169452
2.402022
other
Cd6Pd2
8
194
149.57
mp-984
3.172038
2.429396
0.587967
other
B2N2
4
194
42.13
mp-21380
-7.475094
-4.616522
2.466178
other
Pt2Pb2
4
194
93.94
mp-971768
-5.105663
-3.183815
3.508316
other
Ti6Br2
8
194
137.65
mp-984315
-5.303891
-1.283323
4.583831
other
Be6Ni2
8
194
67.01
mp-13365
-7.096622
-7.002919
3.615705
other
Sr4Zn8
12
194
267.61
mp-1183425
-5.496518
-1.39102
4.670887
other
Be6Co2
8
194
65.48
mp-999120
-5.5516
0.064716
3.467315
other
Tc2B2
4
194
42.57
mp-1187298
-5.038291
-7.561844
3.617366
original
Sr6Eu2
8
194
436.57
mp-1094362
-6.914028
-8.593319
6.492865
other
Mg4Ti2
6
194
121.72
mp-1184173
-6.751475
-6.159544
1.963945
other
Cu2Sn6
8
194
190.11
mp-11883
-8.502489
-2.601336
3.955908
other
Mg4Ir8
12
194
194.79
mp-1102217
-7.869666
-1.830511
4.822655
other
Nd4Ru8
12
194
221.59
mp-1104594
-4.373663
1.281154
3.018267
other
B10Mo4
14
194
136.02
mp-568820
-8.583022
-0.103468
4.470068
other
Pu4Co34
38
194
480.91
mp-1183225
-8.126139
-6.052446
2.128402
other
Ag6Rh2
8
194
136.75
mp-1187980
-6.174
-6.965431
3.921659
other
Yb6Pb2
8
194
248.46
mp-1094093
-3.705806
-0.417976
2.839665
other
Nb2C2
4
194
45.71
mp-974635
-3.884171
-7.101991
1.941499
other
Rb6Ca2
8
194
593.29
mp-972868
-8.038778
-5.868891
2.277405
other
Si2Au6
8
194
139.8
mp-999118
-5.549595
0.005277
3.435255
other
Tc2B2
4
194
42.17
mp-1184728
-6.779409
-4.532179
3.252271
other
Ge6Pt2
8
194
154.95
mp-1186230
-7.832535
-2.325666
3.584085
other
Nb2Rh6
8
194
116.77
mp-569624
-6.624303
-1.342517
4.423512
other
Hf4Cr8
12
194
175.48
mp-1184718
-7.217613
-6.74547
7.02147
other
Ho6Er2
8
194
249.51
mp-973352
-8.143671
-0.759094
4.32794
other
Na2Co6
8
194
125.66
mp-1186038
-4.937308
-7.394224
3.60336
other
Na6Dy2
8
194
268.97
mp-2517816
-5.976267
-3.537749
-2.279372
other
Te4Pb4
8
194
288.39
mp-1186810
2.938314
-0.110461
-1.240821
other
Pu6H2
8
194
106.22
mp-12678
-6.66566
-1.18542
4.550249
other
Ta4Mn8
12
194
167.1
mp-999388
-3.471332
-0.488404
2.680136
other
Nb2C2
4
194
53.41
mp-976223
-3.948046
-7.308394
2.193789
other
K6Sr2
8
194
551.35
mp-1102035
-5.465086
-1.33462
4.048846
other
Sm4Re8
12
194
229.86
mp-1184746
-6.384068
-5.493381
1.175074
other
Ho2Bi6
8
194
243.36
mp-1206035
-5.252286
-5.842161
0.428701
other
Rb2Sb6
8
194
281.96
mp-1101770
-7.826652
-1.722144
4.793795
other
Tm4Ru8
12
194
211.19
mp-1013525
-4.811619
0.539132
-4.46337
other
V2S4
6
194
111.17
mp-1025425
-6.075484
-0.191932
2.524437
other
Co6H2
8
194
66.42
mp-569170
-5.745489
-3.748223
-1.909745
other
Ca4Te4
8
194
263.66
mp-1196175
-9.233676
-1.162817
2.763587
other
Y4Ni34
38
194
472.77
mp-1187413
-8.29815
-6.783123
3.250792
other
Th2Ag6
8
194
181.91
mp-864901
-8.957803
-6.350801
2.609209
other
La2Au6
8
194
181.67
mp-1201182
-9.219532
-1.135409
2.721479
other
Eu4Ni34
38
194
492.85
mp-1186811
-5.846918
-4.649937
3.228159
other
Pu6Mg2
8
194
209.9
mp-1187166
-4.972484
-7.316935
3.91039
other
Sr6Sm2
8
194
379.2
mp-1039492
-7.671237
-8.601307
6.144989
other
Ce2Mg4
6
194
144.14
mp-1682
-5.499742
-2.731898
2.384965
other
Zr4As4
8
194
164.06
mp-978525
-5.199611
-2.740105
4.844118
other
Si6Mo2
8
194
113.79
mp-973615
-5.979038
-4.786226
1.175426
other
Lu2Sb6
8
194
214.38
mp-1184725
-7.381887
-7.566154
2.079139
other
Hg6B2
8
194
168.51
mp-1183280
-6.10975
-7.640456
5.641333
other
Ac6Np2
8
194
323.83
mp-2189
-5.260639
-1.633951
-3.956691
other
Cr2Se2
4
194
75.79
mp-1183605
-6.766663
-7.233757
6.939507
other
Ca2Pm6
8
194
286.66
mp-1187837
-6.254028
-6.362211
5.845491
other
Yb2Ce6
8
194
249.18
mp-1186546
-7.072967
-7.196539
6.798468
other
Pm6Zn2
8
194
224.18
mp-973266
-7.958972
-6.360675
6.650634
other
Lu6Al2
8
194
197.98
mp-1188040
-9.244595
-4.50921
4.217928
other
Zr2Cu6
8
194
117.56
mp-1184147
-5.821198
-5.204777
3.046484
other
Cu2Ge6
8
194
138.39
mp-1185345
-7.16888
-6.765048
6.534336
other
Li2Er6
8
194
227.59
mp-900
-5.015437
-2.088088
-2.849035
other
Rh2Se2
4
194
69.76
mp-10187
-6.028479
-2.581101
-0.337246
other
Te2Ir2
4
194
82.92
mp-972895
-8.991213
-6.111859
2.641996
original
Sc2Au6
8
194
144.88
mp-1186714
-7.019763
-6.941162
7.191272
other
Sm6Eu2
8
194
283.54
mp-21349
-6.381413
-4.810088
3.769474
other
Pu2Ga6
8
194
155.32
mp-1094294
-4.877362
-7.49129
3.50945
other
Sr4Mg2
6
194
272.71
mp-1191219
-8.674444
-2.335646
3.939206
other
Gd6Rh18
24
194
415.23
mp-30602
-7.95331
-9.128314
6.90723
other
Dy4Mg8
12
194
307.72
mp-40793
2.860518
2.347764
1.692318
other
Si6N8
14
194
132.65
mp-1396061
10.231375
10.239865
-3.554087
other
Mo2O6
8
194
116.64
mp-867264
-6.006416
-0.97129
3.923075
other
Re6Os2
8
194
116.91
mp-1183272
-1.672914
-0.153835
-4.582946
other
Ag6Br2
8
194
175.2
mp-1094116
-5.526852
-5.479605
5.426507
original
Mg4Al8
12
194
220.04
mp-1185280
-5.436177
-3.756588
-2.645728
other
Li6Te2
8
194
153.37
mp-569095
-4.91963
-6.429342
0.892381
other
Rb6Bi2
8
194
417.69
mp-1007824
2.29597
2.350984
1.653558
other
Ga2N2
4
194
75.36
mp-1185907
-8.739324
-1.490747
2.699503
other
Mg2Ni6
8
194
97.59
mp-976867
-7.004199
-6.755817
6.79824
other
Pm6I2
8
194
250.06
mp-1184932
-6.561817
-6.674424
2.34633
other
In6Pb2
8
194
222.84
mp-1102680
-7.685094
0.057553
5.774058
other
Er4Fe8
12
194
189.19
mp-1187163
-5.074893
-7.599185
3.725976
other
Sr6Yb2
8
194
413.81
mp-12657
-6.309404
-3.24704
5.377803
other
Hf4Al8
12
194
204.37