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-23263
-0.340748
0.672194
-3.559181
other
La2Br6
8
176
253.37
mp-1180065
6.933034
8.53825
-1.93429
other
Nd2O6
8
176
144.84
mp-23166
-0.585134
0.769287
-3.50741
other
Np2Br6
8
176
244.92
mp-643067
-7.041136
-10.767855
4.50217
other
Mg18Sn6
24
176
548.39
mp-642855
-6.629792
-10.341731
4.55864
other
Mg6Ge2
8
176
178.03
mp-988
2.999478
2.336937
1.692127
other
Si6N8
14
176
145.5
mp-1206505
6.721038
8.747028
-1.807689
other
Gd2O6
8
176
115.75
mp-1238832
1.936916
2.708127
-4.998867
other
Zn2Cl6
8
176
242.28
mp-568170
1.035768
1.699414
-4.854561
other
Tb2Cl6
8
176
192.27
mp-1206285
-8.8448
-6.287897
6.907176
other
Dy6Ru4
10
176
236.67
mp-1025483
6.842403
8.72691
-2.371666
other
Er2O6
8
176
121.24
mp-1214158
7.683264
2.848354
-2.9087
other
C24F24
48
176
592.36
mp-23255
-0.286892
0.568011
-3.646828
other
U2Br6
8
176
248.13
mp-22896
1.078003
1.626703
-4.890471
other
La2Cl6
8
176
215.47
mp-23211
1.050279
1.552084
-4.770694
other
Pr2Cl6
8
176
209.51
mp-31198
-8.780207
-5.896272
6.53212
other
Er6Ru4
10
176
226.82
mp-799
-4.729687
0.25961
-4.305622
other
V6S8
14
176
231.66
mp-1025387
6.815475
8.732638
-2.150569
other
Tb2O6
8
176
128.23
mp-23278
1.367832
2.179779
-4.727451
other
Np2Cl6
8
176
205.68
mp-583712
2.907239
2.465849
1.676573
other
Si18N24
42
176
1,099.48
mp-1080199
0.234424
2.28225
2.159449
other
V6N8
14
176
151.71
mp-510099
-8.507148
-5.910491
2.054397
other
In6Au20
26
176
475.15
mp-23208
1.203174
1.847105
-4.387166
other
U2Cl6
8
176
209.76
mp-1094379
-4.875181
-5.084682
5.186601
other
Mg8Ti6
14
176
278.94
mp-1025565
6.887262
8.74355
-2.053944
other
Ho2O6
8
176
124.03
mp-23225
0.828649
1.958871
-3.920138
other
B2Br6
8
176
263.22
mp-23221
-0.313224
0.588949
-3.472736
other
Pr2Br6
8
176
247.58
mp-542854
-3.448672
-8.045095
7.289008
other
Mg18Si10
28
176
541.95
mp-2004
-6.166415
-4.479056
0.957653
other
Cu20Sb6
26
176
378.31
mp-1016071
0.656544
2.710906
1.759255
other
Cr18N24
42
176
1,493.59
mp-27971
1.219288
1.959178
-5.284328
other
Ac2Cl6
8
176
234.34
mp-1180348
9.916674
10.162093
-3.897545
other
Mo6O20
26
176
395.28
mp-31257
-5.826199
1.401599
-4.646671
other
Mo30S38
68
176
1,436.89
mp-1182484
4.789236
2.451101
-3.173372
other
C6N8
14
176
802.33
mp-1985
6.206853
2.54385
-2.885258
other
C6N8
14
176
87.32
mp-9227
-4.824077
-1.403378
-2.896802
other
Ti6Se8
14
176
303.63
mp-1205565
-8.88441
-6.170285
6.838227
other
Tm6Ru4
10
176
229.27
mp-27972
-0.598796
0.762683
-3.906981
other
Ac2Br6
8
176
272.93
mp-680184
-4.631095
-0.892842
-2.939254
other
Ta52Se104
156
176
3,744.41
mp-1206099
6.765079
8.680112
-2.303744
other
Y2O6
8
176
125.18
mp-1094315
-5.909348
-4.045475
3.353797
other
Zr8Sn6
14
176
322.13
mp-1094481
-4.381283
-4.254459
4.947289
other
Mg8Ti6
14
176
284
mp-23265
1.06698
1.779394
-4.915322
other
Gd2Cl6
8
176
196.3
mp-1205524
-8.851554
-6.137714
6.730806
other
Ho6Ru4
10
176
233.84
mp-12627
-4.097187
-0.446991
-3.075952
other
Nb6S8
14
176
276.4
mp-1094226
-5.890717
-4.059602
3.359016
other
Zr8Sn6
14
176
332.79
mp-554243
15.724741
5.626138
0.374255
other
Si6O12
18
179
323.34
mp-531574
-2.611212
-2.776589
-5.419242
other
Dy22S32
54
18
1,155.01
mp-2503
-4.833879
-2.315915
-3.039299
other
Pd14Se8
22
18
387.27
mp-556296
-3.001743
-1.187982
-5.319179
other
Ba4S12
16
18
440.05
mp-530036
-2.614757
-2.798143
-5.392985
other
Tb22S32
54
18
1,168.85
mp-1080370
-4.251755
-4.982766
-3.414011
other
Ce16Se32
48
18
3,228.29
mp-684744
-6.429404
0.617548
3.503988
other
Fe12N6
18
18
187.8
mp-1227931
-5.519063
-5.9299
0.853197
other
Eu32Sb22
54
18
1,905.96
mp-1224381
10.952798
9.816729
3.803129
other
Hf4O8
12
18
128.33
mp-1227708
-5.148024
-6.005717
0.718807
other
Ca32Sb22
54
18
1,719.66
mp-8939
-5.65859
-1.543322
4.127242
other
Si6W3
9
180
122.82
mp-363
-5.843566
-2.302763
3.810251
other
Nb3Ge6
9
180
146.23
mp-1080351
-4.287821
-4.979117
-3.406636
other
Ce3Se6
9
180
626.92
mp-2478
-5.514117
-2.656541
4.207049
other
Nb3Si6
9
180
131.76
mp-559273
15.557022
5.630652
0.257417
other
Si24O48
72
180
3,404.98
mp-7558
-5.784873
-2.408087
4.337609
other
Ta3Ge6
9
180
144.49
mp-2137
-7.765259
-10.551282
5.236224
other
Mg12Ni6
18
180
300.37
mp-6922
15.170263
5.842253
0.158864
other
Si3O6
9
180
122.9
mp-8938
-5.564162
-1.698618
4.30407
other
Si6Mo3
9
180
119.81
mp-1015612
0.980954
2.451075
2.058172
other
Cr3N6
9
180
105.51
mp-10711
-5.743918
-1.876189
4.515714
other
V3Si6
9
180
112.54
mp-558118
8.909516
1.053464
1.225626
other
Be3F6
9
180
109.3
mp-1084800
-6.371887
-1.437134
4.092361
other
V3Ge6
9
180
129.97
mp-1222
-5.791513
-1.777725
4.684056
other
Cr3Si6
9
180
107.32
mp-517
-5.42529
-2.554904
4.290319
other
Ta3Si6
9
180
128.43
mp-30047
-7.189085
-3.779893
2.733028
other
Sn12Mo6
18
180
375.61
mp-1079810
-6.66417
-4.934223
3.290269
other
Hf3Sn6
9
180
200.12
mp-9281
-6.139736
-3.31574
-2.347891
other
Zn3Te3
6
181
160.13
mp-12524
-6.185496
-1.437191
5.035047
other
Al6W3
9
181
139.56
mp-12104
-5.514089
-2.656889
4.207254
other
Nb3Si6
9
181
131.77
mp-11190
-5.744653
-1.875898
4.515777
other
V3Si6
9
181
112.49
mp-32761
12.833772
8.213647
-1.262985
other
Si6O6
12
181
170.23
mp-10851
15.170113
5.842379
0.158788
other
Si3O6
9
181
122.9
mp-557723
14.846814
5.674191
-0.16651
other
Si12O24
36
181
554.79
mp-11192
-5.438929
-2.592216
4.271212
other
Ta3Si6
9
181
129.87
mp-11191
-5.795865
-1.745037
4.607127
other
Cr3Si6
9
181
104.18
mp-2675163
0.854958
2.892037
1.631667
other
W3N6
9
181
192.78
mp-2872104
-6.127426
-3.488661
-2.347926
other
Cd3Te3
6
181
194.43
mp-1227946
-5.665163
-6.675496
3.604961
other
Ba1Ga2
3
183
88.61
mp-680343
-5.125541
-2.403332
2.341562
other
Ta84Te52
136
183
3,549.39
mp-1182980
0.995478
2.390492
-3.416174
other
Ag1I1
2
183
732.61
mp-1216890
-7.023801
-2.441315
3.201186
other
Ti3Ni3
6
183
83.53
mp-1191157
8.63942
1.598193
1.890764
other
Nd6F18
24
182
310.37
mp-1079760
0.728935
2.318849
1.240392
other
Pd6N2
8
182
109.51
mp-568607
-6.516995
-2.066602
6.125826
other
Al10Mo2
12
182
181.21
mp-1190767
8.632063
1.554226
1.939825
other
Pr6F18
24
182
317.05
mp-559091
15.585057
5.68401
0.376912
other
Si4O8
12
182
190.45
mp-1017
12.356688
9.000493
2.561531
other
Zr6O2
8
182
143.59
mp-22070
8.681413
1.683521
2.121602
other
Ce6F18
24
182
317.28
mp-1804
-6.964817
0.727365
3.890882
other
Fe6N2
8
182
81.61
mp-13154
-7.160809
0.707319
3.571036
other
Fe6C2
8
182
81.28
mp-1205986
-6.083687
0.072879
3.089255
other
Co6N2
8
182
76.38
mp-9761
10.202192
11.149317
-2.394262
other
Re2O6
8
182
91.69
mp-1102877
-8.428528
-4.476742
2.31559
other
Pr2Pd10
12
182
212.78