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-2701
0.533666
1.435287
2.904539
other
Nb2N2
4
194
43.63
mp-999377
-3.50255
-0.514397
2.713352
other
Nb2C2
4
194
48.09
mp-1183254
-3.233286
-1.188106
-5.465189
other
Ag6S2
8
194
144.45
mp-1187048
-7.137138
-5.765327
2.303867
other
Sn6Au2
8
194
201.64
mp-1184454
-5.590916
-3.5987
3.85211
other
Eu2Nb6
8
194
184.99
mp-12070
-5.469071
-3.886286
0.502732
other
Cu2As2
4
194
63
mp-30494
-7.951962
-7.153116
3.873115
other
Sc2Cd6
8
194
169.5
mp-1186063
-7.920966
-0.145476
3.777751
other
Mn2Co6
8
194
83.17
mp-570670
-7.647808
-2.114697
4.67893
other
Y4Os8
12
194
215.43
mp-1191413
-8.699704
-2.39815
3.938299
other
Y6Rh18
24
194
411.63
mp-1183244
-7.830581
-6.557968
1.875854
other
Ag6F2
8
194
133.76
mp-1094309
-4.902543
-7.474859
3.57274
other
Sr6Mg2
8
194
356.05
mp-1186030
-5.575968
-7.229074
2.889558
other
Na6Au2
8
194
196.48
mp-1198632
-9.372181
-6.124681
4.178906
other
Gd4Zn34
38
194
621.31
mp-13548
-4.294786
-6.529035
1.530399
other
Cs4Pt2
6
194
230.64
mp-22878
-6.30918
-5.16338
0.646645
other
Mn2Bi2
4
194
101.93
mp-570684
-7.626095
-2.065773
4.508799
other
Zr4Os8
12
194
201.79
mp-1184000
-5.758401
-4.702963
3.427242
other
Ce2Pu6
8
194
205.73
mp-1187296
-7.283387
-6.715567
6.85998
other
Tb6Mg2
8
194
238.11
mp-1079370
2.841196
-0.351975
-1.728499
other
Er2H6
8
194
65.78
mp-1185974
-6.325147
-6.986032
2.386015
other
Mg2Pb6
8
194
231.35
mp-1185161
-6.596782
-6.409602
6.509645
other
La6Ti2
8
194
252.66
mp-1095495
-8.892118
-6.742963
5.090956
other
Y4Zn8
12
194
226.04
mp-1188080
-5.656028
-7.281551
4.133113
other
Yb6Eu2
8
194
325.76
mp-1186096
-5.095694
-7.510732
3.32514
other
Na6Yb2
8
194
309.58
mp-1187117
-6.621103
-6.286121
2.064276
other
Sn6Pb2
8
194
226.31
mp-8511
8.509853
2.315101
-1.290428
other
P2F10
12
194
154.79
mp-864889
-7.850215
-4.922282
3.949283
other
Zr2Zn6
8
194
128.24
mp-1105856
-7.869129
-3.38883
2.488291
other
Np4Pt12
16
194
285.34
mp-569668
-4.942367
-1.421918
-3.293227
other
V2Se2
4
194
71.14
mp-1184747
-5.874269
-3.883992
4.067778
other
Hf6Ni2
8
194
151.81
mp-862665
-6.553533
-4.577002
5.033756
other
Ac2Ge6
8
194
188.03
mp-862857
-3.994869
-0.960669
-4.587144
other
Pa2S6
8
194
145.7
mp-1184302
-7.297839
-6.758535
7.057672
original
Er2Tm6
8
194
245.69
mp-1202952
-6.177852
-4.158963
6.029715
other
Tb4Al34
38
194
690.36
mp-1080330
-4.015786
-3.880428
-3.251707
other
Ce2Se4
6
194
141.36
mp-1188018
-5.759495
-3.615654
4.095677
other
Zr6Al2
8
194
168.61
mp-1186521
-6.828056
-7.246878
7.21271
other
Pm6Ho2
8
194
272.74
mp-979923
-7.464134
-1.216454
5.283131
other
Sm2Mn6
8
194
145.42
mp-999195
0.488042
2.076508
1.941394
other
Ru2N2
4
194
40.34
mp-1184038
-4.53711
-5.838312
0.890891
other
Cs6I2
8
194
797.34
mp-1186918
-5.663213
-4.280692
4.042646
other
Pu2Hf6
8
194
180.64
mp-1185588
-7.639214
-6.836385
6.597262
other
Gd6Ag2
8
194
226.38
mp-1207123
-5.790963
-3.092769
1.960556
other
Nb2Sb2
4
194
85.24
mp-1183654
-7.523559
-6.094967
2.499446
other
Cd6Pt2
8
194
149.69
mp-976373
-3.911378
-7.189509
2.448492
other
K6Y2
8
194
452.5
mp-977129
-8.241694
-4.527538
1.943421
other
Hg2Pd6
8
194
130.39
mp-1186676
-6.801765
-6.891529
7.135219
other
Pm2Y6
8
194
274.51
mp-1186042
-4.938294
-7.477564
3.189929
other
Na6Ca2
8
194
310.54
mp-1184017
-5.769027
-4.190134
0.60008
other
Cu6As2
8
194
102.44
mp-1183368
-4.681887
-7.273949
3.6131
other
Ba6Pr2
8
194
426.87
mp-774873
-4.090324
-0.112892
-3.654637
other
Nb2S4
6
194
140.24
mp-8374
-3.728318
-1.980068
-5.208156
other
Na4S2
6
194
124.99
mp-867004
-9.21505
-1.384565
2.889486
other
Th8Ni28
36
194
530.61
mp-570466
-5.458435
-7.118622
3.650717
other
Li8Ca4
12
194
338.28
mp-1186211
-8.391007
-6.404314
3.468222
other
Na2Zn6
8
194
145.51
mp-1190774
-5.503222
-2.476025
3.696433
other
Ta12Ga10
22
194
378.74
mp-21092
-8.344501
-1.802385
2.511785
other
In2Ni4
6
194
84.41
mp-557720
8.70844
1.708548
2.11074
other
Ce6F18
24
194
316.5
mp-1186088
-5.571348
-7.423195
2.936894
other
Na6Tl2
8
194
238.72
mp-1188035
-5.370903
-3.720481
4.042789
other
Zr6Si2
8
194
161.11
mp-985540
-6.200749
-7.862086
5.91324
other
Ac6La2
8
194
362.56
mp-1184474
-8.367764
-7.069456
3.223368
other
Gd2Ag6
8
194
173.25
mp-1079863
-7.561594
-0.701256
3.876729
other
Ti2Co6
8
194
93.18
mp-680401
-9.202166
-5.780542
4.268319
other
U12Zn102
114
194
1,844.81
mp-1201388
-9.193093
-6.224602
4.591933
other
Tb26Zn116
142
194
2,477.6
mp-17023
-8.462337
-1.958531
3.50435
other
U4Ni8
12
194
170.72
mp-11282
-5.604819
-1.144055
4.197075
other
Be8W4
12
194
124.98
mp-1196386
-8.68434
-0.453806
4.827917
other
Ce8Co28
36
194
503.34
mp-1186266
-7.075591
-6.892784
7.329177
other
Nd6Dy2
8
194
279.45
mp-1101968
-6.106011
-1.486337
4.340693
other
Ho4Tc8
12
194
217.08
mp-1187741
-8.658823
-5.558766
2.344081
other
V2Au6
8
194
139.46
mp-1188006
-7.156755
-6.302792
2.953985
other
V2In6
8
194
174.97
mp-1094989
-5.11724
-7.362677
3.864201
other
Ca6Mg2
8
194
294.49
mp-1183261
-7.910434
-6.096022
2.323293
other
Ag6Ru2
8
194
137.79
mp-1185970
-7.454341
-0.412159
4.146711
other
Mn6Co2
8
194
84.71
mp-1186979
-7.302425
-5.455245
5.235097
other
Sc6V2
8
194
171.07
mp-1184351
-5.661261
-5.712801
3.784719
other
Ga6B2
8
194
136.76
mp-1094431
-7.648874
-10.800677
4.940079
other
Mg4Zn2
6
194
119.98
mp-1186794
-7.109233
-6.950143
7.361898
other
Pr6Gd2
8
194
294.21
mp-1187135
-4.416395
-6.230782
2.0638
other
Sr6P2
8
194
269.41
mp-1187985
-5.669278
-7.208198
4.469175
other
Yb6Nb2
8
194
245.5
mp-1186636
-8.85202
-2.709208
3.683739
other
Pm2Rh6
8
194
137.59
mp-867345
-7.616689
-1.611979
3.844888
other
Tc2Ir6
8
194
113.65
mp-1187671
-5.94342
-3.151254
3.964045
other
Ti6Ni2
8
194
118.79
mp-1185214
-6.217203
-6.521446
3.438831
other
Li6Ni2
8
194
114.3
mp-972042
-9.830989
-4.666907
3.501704
other
Zn6Cu2
8
194
105.63
mp-978510
-3.991011
-4.868208
5.676394
other
Si6As2
8
194
129.28
mp-1094436
-8.498754
-7.449892
3.721735
other
Mg2Zn4
6
194
104.5
mp-1183659
-4.870044
-4.74953
0.210993
other
Cd2As6
8
194
163.77
mp-1187397
-6.045549
-1.042752
4.184409
other
Tc6Sn2
8
194
127.41
mp-1403606
7.813493
5.865141
-2.260517
other
W2O4
6
194
92.4
mp-11482
-7.41457
-1.31307
3.472841
other
Mo2Ir6
8
194
115.59
mp-972941
-6.19255
-5.761999
0.669647
other
Na2Bi6
8
194
240.99
mp-865496
-7.610193
-1.494134
3.661951
other
V2Ir6
8
194
110.85
mp-1186115
-8.527067
-6.243929
2.235773
other
Na2Au6
8
194
149.36
mp-8033
8.722599
1.926611
1.77686
other
Pu2F6
8
194
103.99
mp-984725
-6.265441
-7.331883
2.691206
other
Ba2Tl6
8
194
269.39
mp-1186060
-7.457411
-1.182256
4.302169
other
Mn2Os6
8
194
108.33
mp-1094451
-7.543547
-10.825801
5.265212
other
Mg6Zn2
8
194
156.24