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-1193237
10.291849
7.798485
-0.843916
other
Ba2Al10O18
30
194
380.69
mp-15686
-5.150462
-4.658486
0.63652
other
Li4Cu2As2
8
194
117.58
mp-7940
-4.567064
-1.641994
-3.026021
other
K2Nb2Se4
8
194
187.51
mp-11816
-5.818952
-6.565162
3.526272
other
Ba2Cd2Ge2
6
194
185.08
mp-1193286
-4.550422
-1.047657
-2.848667
other
Nb8Fe4Se16
28
194
566.36
mp-1102026
-5.530926
-6.249658
3.760349
other
Ba4Ga4Ge4
12
194
336.73
mp-611601
8.775835
0.567287
0.423277
other
Cs2Ni2F6
10
194
259.15
mp-23451
-0.50765
1.375439
-4.827347
other
Cs6Cr4Br18
28
194
961.19
mp-1223870
-6.624685
-3.530537
5.063419
other
Hf4Al6Pd2
12
194
201.89
mp-1077329
-5.003833
-3.454995
0.968928
other
Gd2P2Pd2
6
194
115.32
mp-1079775
11.32129
12.568149
0.008722
other
K2Cr2O4
8
194
96.2
mp-1206345
-7.761413
-0.953942
3.161519
other
In2Fe2Ni2
6
194
88.08
mp-1178449
9.397717
8.248632
2.042059
other
Cs2La2O4
8
194
168.88
mp-574915
8.866073
13.265409
-1.068545
other
La2Fe24O38
64
194
721.72
mp-727331
9.145257
7.527696
-3.920671
other
Co2H2O4
8
194
70.97
mp-1025441
-4.528945
-0.756295
3.210849
other
Ta4Al2C2
8
194
114.51
mp-1203663
-8.881334
-0.226036
4.128751
other
Er4Co24Ni10
38
194
478.59
mp-568934
0.798643
1.403646
2.720769
other
Ti8Al2N6
16
194
180.65
mp-754342
8.809213
11.57518
1.067992
other
Sc2Fe2O6
10
194
117.43
mp-1226069
-6.516157
-0.560796
3.275227
other
Co6Si2Mo4
12
194
141.97
mp-3744
13.001468
9.969294
1.781625
other
Na2Nb2O4
8
194
88.27
mp-1205638
0.226119
2.079332
-4.444814
other
Cs6Br2O2
10
194
379.58
mp-13160
-6.988778
-4.605825
5.481487
other
Y4Zn4Ge4
12
194
241.37
mp-20175
-3.001723
-0.401483
3.265552
other
Sc4In2C2
8
194
149.02
mp-571402
-2.504611
0.2714
2.515484
other
Zr4Al6C10
20
194
226.4
mp-31018
-5.974118
-6.275858
0.978152
other
Sr2Ag2Bi2
6
194
182.16
mp-5933
9.661094
10.701683
3.280384
other
Ba6Ti6O18
30
194
400.24
mp-19746
-3.89302
-0.325823
-3.790318
other
Nb2Pb2S4
8
194
177.51
mp-3732
-3.788053
-0.21503
2.69992
other
Ti4C2S2
8
194
99.89
mp-8126
-5.130831
-4.150049
5.662275
other
Y2Cu2Si2
6
194
111.47
mp-1102854
-5.33962
-1.764242
0.855125
other
Y4Ni4P4
12
194
201.94
mp-1208548
-7.231665
-2.199012
6.262868
other
Tb6Al24Os8
38
194
637.15
mp-13071
-2.907908
-0.610288
3.165828
other
Sc4Tl2C2
8
194
149.81
mp-15109
-3.327317
-3.819859
0.703893
other
Sm2Zn6P6
14
194
276.22
mp-1194003
-5.87656
-3.03985
4.131591
other
Hf18Si2Mo8
28
194
565
mp-1071595
-8.560512
-6.337834
2.997128
other
Pr2Sn2Au2
6
194
157.1
mp-1191645
-9.193407
-1.585613
3.015099
other
Ho6Al2Ni16
24
194
349.98
mp-1246645
0.143811
2.155226
2.460214
other
Ti2Fe2N4
8
194
69.95
mp-11212
-5.94156
-4.064127
0.658823
other
La2As2Pd2
6
194
134.68
mp-985439
-3.508726
-4.483913
1.101191
other
Ba2P2Au2
6
194
156.23
mp-568594
-4.568057
-3.791828
-3.770704
other
Cs2Yb6Se8
16
194
478.21
mp-1203778
-7.662202
0.890179
5.050624
other
Tm4Ga4Fe30
38
194
524.22
mp-1210773
-7.745536
-1.501457
2.977822
other
Mn2Ga2Ni2
6
194
76.27
mp-1220720
-6.702841
-1.142107
3.68149
other
Nb4Co6Ge2
12
194
156.22
mp-1196408
-8.674166
0.43278
4.472484
other
Sm8Co20B8
36
194
448.15
mp-1245399
1.146189
2.391578
1.893038
other
Zn6Cr2N6
14
194
169.54
mp-13163
-7.446967
-5.921409
4.394386
other
Tb4Zn4Sn4
12
194
277.96
mp-1213058
-7.134203
-0.455902
4.266675
other
Er4Mn34C6
44
194
514.7
mp-1245931
0.415797
2.678073
1.72317
other
Co2Pt2N4
8
194
81.93
mp-1102152
-5.434824
-1.811794
0.878003
other
Dy4Ni4P4
12
194
200.32
mp-755651
9.504725
8.155805
1.789048
other
Cs2Gd2O4
8
194
152.99
mp-1247362
5.352472
2.149539
-2.843847
other
Cr2C2N4
8
194
86.1
mp-1080052
7.324006
5.952232
-1.822702
other
Li2I2O6
10
194
99.65
mp-2918
9.617917
9.185157
2.597899
other
Y2Cu2O4
8
194
122.49
mp-979041
-2.04124
0.449931
2.411743
original
Tm2Al6C6
14
194
170.87
mp-616672
-4.982477
-0.875786
-5.208627
other
Ga4Fe4S10
18
194
337.94
mp-1212250
-9.056359
-1.833901
3.197493
other
La6Zn6Ni12
24
194
396.46
mp-555778
8.555214
13.18315
-1.19019
other
Fe24Pb2O38
64
194
715.76
mp-1238775
-3.173773
1.002054
2.807098
other
Na2B2C2
6
194
56.62
mp-1078242
-8.585041
-4.908219
3.413888
other
Y2Al2Pd4
8
194
149.91
mp-1193179
1.557415
2.683807
-5.789971
other
Cs6Cr4Cl18
28
194
835.64
mp-1194135
-1.362499
2.579861
-2.265832
other
Cs6Er4I18
28
194
1,335.47
mp-31190
-7.945492
-4.540154
5.670926
other
Lu8Ga12Co4
24
194
443.08
mp-15819
-6.732017
-2.109957
6.132949
other
Mn6Al18Si2
26
194
372.26
mp-553308
9.456464
8.15145
1.99262
other
Cs2Nd2O4
8
194
161.93
mp-20565
-7.214614
-0.978256
3.201867
other
Mn2Co2Ge2
6
194
74.56
mp-7359
-4.645489
-5.45279
0.642971
other
Ba2Ag2As2
6
194
168.63
mp-1210878
1.261894
2.040249
2.251827
other
Li2Ta2N4
8
194
83.49
mp-1212897
-5.021475
-3.981532
5.811077
other
Er8Si12Pd4
24
194
452.03
mp-569151
-8.012789
-2.821826
2.727203
other
Mn2Ga2Pt2
6
194
90.47
mp-1217248
-6.334289
-2.777619
5.064174
other
Ti4Al6Ni2
12
194
178.26
mp-7939
-4.692803
-1.413017
-2.991654
other
Na2Nb2Se4
8
194
163.88
mp-23029
-1.335046
2.966205
-2.90623
other
Cs6Sb4I18
28
194
1,328.92
mp-1018676
-6.099186
-4.819965
0.86803
other
Ce2Sb2Au2
6
194
153.83
mp-541294
-5.998311
-1.255406
0.912389
other
Sr2Ni18P10
30
194
385.87
mp-1018745
-6.228118
-4.645547
0.706487
other
La2Sb2Pd2
6
194
153.39
mp-1385937
11.637611
12.302019
-0.202578
other
Al2Cr2O6
10
194
102.81
mp-1212805
-3.347788
-3.86953
0.721494
other
Er2Zn6P6
14
194
267
mp-1217125
-3.864568
-0.343779
3.038382
other
Ti8Ga2C6
16
194
190.95
mp-545643
8.475538
3.70156
-7.021528
other
Ba2C2O6
10
194
149.79
mp-568234
-6.343569
-6.781427
2.479696
other
Na8Ca2Sn12
22
194
644.61
mp-1206817
1.591914
2.474902
-5.10034
other
Tl2V2Cl6
10
194
255.39
mp-801028
9.298806
9.21334
1.494971
other
Ba8Sb4O18
30
194
535.57
mp-997180
12.702892
13.082062
-0.81138
other
V2Cu2O4
8
194
93.35
mp-1232375
-4.269146
0.393942
2.914799
other
Hf2B2C2
6
194
56.58
mp-1191846
-9.252509
-1.606561
2.946244
other
Tb6Al2Ni16
24
194
357.96
mp-1025011
-7.421853
-1.41686
2.697894
other
Fe2Ni2Sn2
6
194
83
mp-20650
-7.010723
-3.797655
5.279408
other
Ce2Cr2Ge6
10
194
192.21
mp-9958
-3.735419
-0.395367
3.009349
other
Ti4Ge2C2
8
194
106.61
mp-1192116
-9.162791
-0.83118
2.799302
other
Y6Ni14B4
24
194
318.44
mp-766248
12.642181
7.572083
0.598845
other
Al22In2O34
58
194
638.95
mp-1192069
-9.203791
-0.778818
2.851496
other
Ho6Ni14B4
24
194
308.95
mp-541813
8.535448
0.689635
1.623407
other
Rb6Mg6F18
30
194
416.38
mp-1224902
-6.967471
-4.404609
6.452374
other
Gd2Er2Al12
16
194
304.47
mp-1079726
1.690594
1.736811
2.64503
other
Zr4Se2N4
10
194
153.31
mp-755252
12.256655
6.509743
-0.323139
other
Dy2H2O4
8
194
99.54
mp-1207854
-5.46839
-3.219761
1.064366
other
U4Ni4As4
12
194
222.61
mp-1208103
-7.213557
-1.686731
6.250696
other
U6Al24Fe8
38
194
602.27
mp-1215596
-6.832863
-4.423148
6.154739
other
Yb2Y2Al12
16
194
312.17
mp-1211824
8.79476
2.375882
1.923124
other
K2U12F50
64
194
964.27