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-972257
-6.942813
-6.714451
6.997683
other
La2Tb6
8
194
277.61
mp-27838
-5.472013
-6.468904
0.81612
original
Na6Bi2
8
194
245.59
mp-865605
-0.477536
0.796146
-3.805522
other
Y2Br6
8
194
323.89
mp-1201237
-7.782439
-4.667369
5.615837
other
Dy10Ga30
40
194
755.8
mp-1187826
-6.533099
-6.126686
1.908868
other
V2Sn6
8
194
180.89
mp-1184316
-7.27907
-5.427976
3.2539
other
Ga6Au2
8
194
147.32
mp-1008488
-6.81636
-4.62791
0.301002
other
Bi2Pd2
4
194
90.43
mp-1041984
9.901568
9.728143
-0.128972
other
Sn2O4
6
194
97.53
mp-1018947
1.007423
2.248462
1.585836
other
Pt2N4
6
194
70.32
mp-1102354
-6.102157
-1.525932
4.321191
other
Th4Tc8
12
194
232.12
mp-1186369
-7.687556
-5.711402
1.90873
other
P2Au6
8
194
142.71
mp-983582
-7.055247
-6.84879
7.068651
other
Ca2Nd6
8
194
291.57
mp-983550
-5.470349
-5.233769
5.089207
other
Pa6Nb2
8
194
188.98
mp-1184402
-5.389885
-7.464168
4.390359
other
Eu6Dy2
8
194
313.69
mp-569446
-7.250488
-4.9141
1.937649
other
Ni2Pb2
4
194
77.54
mp-20760
-7.215829
-6.377923
5.777343
other
La4In2
6
194
198.12
mp-1186264
-7.133169
-6.545805
6.680987
other
Nd6Br2
8
194
249.37
mp-12120
0.154714
2.707397
1.839855
other
Fe2N2
4
194
32.5
mp-30625
-7.72895
-7.171971
5.825348
other
Dy4Tl2
6
194
166.84
mp-864894
-5.653359
-1.459102
4.497338
other
Be6Rh2
8
194
74.97
mp-1187543
-3.756263
-1.417334
-5.096806
other
Tl2S6
8
194
182.19
mp-1187328
-6.76141
-6.514085
6.876003
other
Tb6Th2
8
194
261.12
mp-1183963
-4.072679
-6.914084
1.517141
other
Cs2Rb6
8
194
824.43
mp-973165
-7.262887
-6.519009
6.546842
other
Lu6U2
8
194
227.6
mp-865612
-7.492503
-7.059664
2.631519
other
Li2Cd6
8
194
156.78
mp-1186447
-8.532398
-5.457186
2.061576
other
Pd2Au6
8
194
135.23
mp-1188000
-9.192064
-5.717608
2.793631
other
Zn6Au2
8
194
119.04
mp-567832
-5.487026
-2.231281
-1.240257
other
Ti2Te2
4
194
85.22
mp-1185788
-8.13924
-10.982477
6.009403
other
Mg6Cr2
8
194
165.16
mp-980750
-5.0401
-4.411942
0.419776
other
Y2As6
8
194
175.02
mp-975921
-7.508071
-1.569068
4.404222
other
Hf2Ru6
8
194
123.91
mp-1094123
12.835294
10.931887
-0.972257
other
Mo2O4
6
194
74.02
mp-865400
-8.177007
-3.585767
2.671404
other
Th2Pt6
8
194
151.06
mp-982244
-6.516828
-5.597251
5.710685
other
Pa6H2
8
194
159.01
mp-1186565
-7.070909
-7.044082
7.345954
other
Pm2Dy6
8
194
261.45
mp-862983
1.59686
2.527978
-5.155588
other
In2Cl6
8
194
271.63
mp-1186276
-7.093422
-6.916909
7.339603
other
Nd6Ho2
8
194
280.64
mp-1102378
-5.374882
-1.279511
4.048976
other
Nd4Re8
12
194
233.95
mp-30787
-7.439177
-1.413814
3.438763
other
Mo2Rh6
8
194
112.46
mp-11345
-5.253183
-2.665414
2.361122
other
Zr4P4
8
194
149.7
mp-564
-6.300035
-2.77527
-0.883521
other
Te2Pd2
4
194
86.91
mp-1184858
-9.335793
-4.604044
3.74948
original
In2Cu6
8
194
110.8
mp-977229
-6.276734
-6.941239
3.450107
other
Li6Cr2
8
194
146.01
mp-594
-5.656231
-1.182233
-3.876944
other
Ni2S2
4
194
53.06
mp-865324
1.246321
1.895443
-5.094752
other
Lu2Cl6
8
194
269.36
mp-1185522
-7.839224
-6.779756
5.957359
other
Lu6Tl2
8
194
212.26
mp-1183206
-8.029171
-6.175856
1.964768
other
Ag6Pd2
8
194
133.36
mp-974030
-8.828305
-2.509371
3.900856
other
La6Rh18
24
194
434.43
mp-581958
-7.889991
-7.191687
3.797308
other
Nd26Cd116
142
194
3,349.75
mp-1072192
-3.949
-0.744955
-4.423133
other
Ti2S4
6
194
92.04
mp-1183846
-7.607434
-6.728817
7.071079
other
Dy2Lu6
8
194
238.91
mp-10052
-5.443664
-2.422595
2.051407
other
Ti2As2
4
194
70.65
mp-1387606
7.413501
9.621058
-3.745295
other
Cr2O6
8
194
108.18
mp-865565
-6.25912
-6.367209
2.044644
other
Cs2Sn6
8
194
321.53
mp-1064554
-6.951533
-4.103589
0.478863
other
Bi2Rh2
4
194
84.18
mp-1184515
-5.809721
-7.151151
3.891424
other
Eu6In2
8
194
270.92
mp-1187810
-5.064919
-3.836086
3.523295
other
U6Ta2
8
194
167.68
mp-1184203
-6.091596
-6.870835
2.993175
other
Eu6Sb2
8
194
261.86
mp-1018733
0.783569
2.136303
1.752551
other
Ir2N4
6
194
62.18
mp-1183756
-7.597292
-1.026871
3.126178
other
Co6I2
8
194
136.97
mp-11456
-7.989256
-2.917534
2.66997
other
Hf4Pt12
16
194
256.96
mp-1183705
-6.630204
-0.938393
3.717168
other
Cr6Pt2
8
194
100.54
mp-973065
-3.580926
-3.775644
0.730472
other
La2P6
8
194
159.56
mp-2192
-8.155693
-2.734189
2.558242
other
B2Pt2
4
194
44.06
mp-1185197
-5.563268
-6.89921
3.865136
other
Li6Ho2
8
194
184.64
mp-1018053
-9.001973
-4.966918
3.587109
other
In2Cu2
4
194
74.58
mp-1191930
-8.553551
-2.539012
4.048759
other
Ce6Ir18
24
194
428.55
mp-7821
-6.241779
-2.975076
1.142828
other
V2Sb2
4
194
82.99
mp-10033
-4.077607
-0.033255
-3.781081
other
Nb2S4
6
194
124.08
mp-1184026
-8.588955
-4.496647
3.000302
other
Cu6Ru2
8
194
100.86
mp-1195194
-8.55579
-0.133438
4.386768
other
Np4Co34
38
194
443.79
mp-975586
-7.030888
-6.952287
7.424648
other
Pr6Y2
8
194
289.23
mp-510198
-7.820035
-3.823185
3.105551
other
Ir2Pb2
4
194
86.62
mp-1185338
-9.362045
-4.785978
3.827836
other
Li2Cu6
8
194
92.57
mp-863264
-1.378091
1.867472
-1.916577
other
Tb2I6
8
194
437.81
mp-557523
-4.720179
0.329962
-4.611372
other
V2S4
6
194
206.54
mp-1185269
-5.673131
-6.892699
3.96136
other
Li6Gd2
8
194
179.85
mp-999357
0.618871
1.448752
2.864749
other
Nb2N2
4
194
44.5
mp-20033
-7.969744
-3.309819
3.248227
other
Sn2Ir2
4
194
77.96
mp-959
-7.048421
-4.511375
6.302384
original
La2Al6
8
194
179.41
mp-974662
-3.85983
-7.111071
1.975392
other
Rb6Pr2
8
194
549.75
mp-1102084
-6.114859
-1.435198
4.353705
other
Dy4Tc8
12
194
218.64
mp-1184688
-7.430402
-7.382929
1.706803
other
Hg6Ge2
8
194
190.25
mp-1185288
-7.041973
-6.554308
3.4573
other
Li6W2
8
194
115.23
mp-865956
1.825367
2.628668
-4.516719
other
Ir2Cl6
8
194
274.17
mp-1183355
-4.723742
-7.307718
3.671247
other
Ba6Y2
8
194
415.97
mp-867357
-6.1156
-0.804098
4.049609
other
Tc6Ni2
8
194
105.62
mp-1102438
-7.884532
-1.740791
4.842658
other
Sm4Ru8
12
194
217.57
mp-27652
-0.800656
1.288801
-1.738124
other
Th4I8
12
194
452.98
mp-1186190
-6.631521
-6.429918
2.172086
other
Na2Sn6
8
194
209.44
mp-11453
-8.517675
-4.44931
2.415003
other
Hf4Pd12
16
194
251.9
mp-757
-4.894856
-5.129946
0.450287
other
Li6As2
8
194
126.43
mp-1186374
-7.013426
-1.062916
4.133101
other
Os6W2
8
194
116.39
mp-999516
-5.638367
-1.142282
1.553213
other
Mn2P2
4
194
51.85
mp-20608
-7.793653
-6.483886
6.025048
other
Tb4In2
6
194
169.95
mp-984744
-5.48907
-7.358335
3.71612
other
Ca6Tl2
8
194
262.37
mp-862986
-0.463131
0.730211
-3.883741
other
Pm2Br6
8
194
335.27
mp-978252
-9.310608
-5.891212
4.30924
other
Ce4Zn34
38
194
616.08
mp-1185135
-0.733052
1.249766
-4.26403
other
K2Br6
8
194
252.37
mp-1187690
-6.589961
-6.363101
1.75727
other
Tl2Sn6
8
194
229.69