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-1190357
-6.614033
-4.260379
6.273614
other
Sm4Al20
24
182
459.03
mp-30337
-6.513741
-2.051245
6.313423
other
Al10W2
12
182
180.94
mp-2033
0.312849
2.332713
1.717614
other
Ni6N2
8
182
76.81
mp-1080698
-7.336612
0.826486
3.879431
other
Fe6B2
8
182
84.52
mp-1200317
-7.817792
-1.629654
2.456015
other
Ni30Ge12
42
185
481.47
mp-1337236
7.878422
7.650348
-3.421827
other
Te6O18
24
185
411.92
mp-1101228
9.861728
2.412576
0.018427
other
V4F18
22
185
332.4
mp-542429
-7.987753
-9.11002
5.14083
other
Mg18Rh6
24
185
441.71
mp-334
8.533546
1.334982
2.101775
other
La6F18
24
185
325.91
mp-18712
-7.889359
-9.70226
4.817318
other
Mg18Pd6
24
185
459.87
mp-1193977
-2.666258
-2.773971
-5.681916
other
Lu12S18
30
185
715.2
mp-18707
-8.079649
-9.189288
4.619603
other
Mg18Pt6
24
185
449.89
mp-7463
-4.87977
-3.793686
0.593534
other
Cu18P6
24
185
294.03
mp-31286
-5.060798
-6.471397
0.92179
other
K18Bi6
24
185
1,092.56
mp-1369275
10.273522
10.243084
-3.60674
other
Mo6O18
24
185
360.63
mp-690346
10.572237
11.164163
-3.060648
other
W6O18
24
185
364.45
mp-1330490
7.079624
9.813171
-3.657882
other
Cr6O18
24
185
311.81
mp-17783
-7.768426
-8.881985
4.002081
other
Mg18Au6
24
185
474.95
mp-542220
-4.382494
-5.874267
0.788454
other
Cs18As6
24
185
1,153.01
mp-16316
-7.08946
-1.09451
2.297208
other
Co30As12
42
185
493.81
mp-704981
-7.044785
-1.001601
3.627865
other
Mn30Ge12
42
185
527.61
mp-1105976
-3.34954
1.727657
2.870378
other
Li2B18
20
185
143.11
mp-1200923
-6.31525
-1.130559
1.071104
other
Ni30P12
42
185
454.39
mp-32662
10.523661
11.207396
-3.127733
other
W6O18
24
185
378.2
mp-655
-4.659615
-5.868579
0.582304
other
Na18As6
24
185
588.92
mp-568419
-8.169878
-8.741687
5.188982
other
Mg18Ir6
24
185
437
mp-1330336
11.048013
10.858393
-2.750613
other
W6O18
24
185
366.04
mp-1193566
-2.689608
-2.79497
-5.575477
other
Tm12S18
30
185
745.28
mp-30370
-8.119352
-6.495941
2.225167
other
Cd18Au6
24
185
502.31
mp-573084
-3.120195
-2.225849
-5.105521
other
Yb12S18
30
185
706.99
mp-569451
-7.120215
-4.116802
0.912487
other
Sb12Pd30
42
185
714.17
mp-1190632
2.09163
1.893162
0.857831
other
Na18N6
24
185
403.16
mp-1178678
3.01675
-0.587665
-1.985057
other
Y6H18
24
185
229.25
mp-941
-6.538771
-1.647791
1.287484
other
Ni30As12
42
185
490.25
mp-18511
8.641515
1.532521
1.987619
other
Nd6F18
24
185
305.69
mp-18299
8.879205
2.810795
1.991234
other
U6F18
24
185
322.82
mp-1214686
-7.143309
-3.904101
1.298898
other
As12Pd30
42
185
647.11
mp-703459
10.632259
3.333541
-4.141334
other
H24O12
36
185
344.44
mp-1039549
-7.66731
-8.883873
6.261929
other
Ce2Mg4
6
189
163.41
mp-1094161
-7.638095
-8.94218
6.424296
other
La2Mg4
6
189
171.61
mp-1094558
-7.101572
-11.020953
5.548333
other
Li1Mg5
6
189
131.52
mp-1185952
-8.09321
-2.981141
2.521783
other
Mg1Pt5
6
189
94.56
mp-976128
-5.812178
-4.102703
4.192838
other
Hf5Sc1
6
189
134.59
mp-2340
7.730465
5.657209
-3.150504
other
Na6O6
12
189
144.25
mp-1080831
-7.027456
-3.907969
1.241435
other
As3Pd6
9
189
141.04
mp-1039273
-6.800152
-10.717772
5.960014
other
Ca1Mg5
6
189
152.95
mp-1185817
-7.189916
-10.330239
5.003002
other
Mg5In1
6
189
134.64
mp-1094343
-5.364592
-3.087747
3.995192
other
Mg1Ti5
6
189
107.15
mp-1094442
-7.706625
-9.932379
6.730168
other
Y1Mg5
6
189
146.6
mp-1185833
-7.961816
-6.693337
2.079338
other
Mg1Ag5
6
189
104.6
mp-1094240
-6.628691
-6.150871
2.0566
other
Mg1Sn5
6
189
155.3
mp-1185819
-7.740241
-9.778225
6.441417
other
Mg5Sc1
6
189
137.29
mp-1094651
-6.249025
-5.576668
3.648785
other
Mg1Ga5
6
189
109.42
mp-1200130
-5.449176
-7.042934
1.659564
other
Rb15Tl27
42
189
1,683.53
mp-1049
-4.769754
-5.356091
0.581442
other
Sr6As6
12
189
373.05
mp-9268
-4.71518
-2.835862
-3.791485
other
K6Se6
12
189
418.75
mp-1094446
-7.894761
-9.471715
6.993759
other
Y2Mg4
6
189
158.44
mp-1071163
12.723184
9.788157
1.823348
other
Ti3O3
6
189
61.94
mp-1182200
11.21516
8.737786
2.401304
other
Ce2O3
5
189
105.76
mp-7931
-3.412557
-4.633589
0.734752
other
Sr6P6
12
189
342.36
mp-1185803
-7.505974
-11.01973
5.383759
other
Mg5Cu1
6
189
119.34
mp-1185863
-5.560915
-5.220758
3.086739
other
Mg1Ge5
6
189
116.55
mp-1079254
-6.926407
-1.156958
2.145302
other
Co6As3
9
189
109.87
mp-1119338
9.42928
9.391735
0.276165
other
Na6O3
9
189
113.27
mp-865604
-5.895132
-7.007746
3.405266
other
Li5Mg1
6
189
121.73
mp-998917
7.647875
5.613741
-2.973339
other
K6O6
12
189
215.35
mp-1185818
-6.938594
-10.563392
4.790698
other
Mg5Pb1
6
189
140.26
mp-1184282
-6.848422
-10.240611
5.956687
other
Eu1Mg5
6
189
159.81
mp-767
-6.38486
-5.362346
4.056012
other
Yb3Ge5
8
189
179.93
mp-8591
-4.125188
-3.566029
-2.450253
other
U3Se6
9
189
213.77
mp-567680
1.135352
1.602287
-5.075163
other
Ba3Cl6
9
189
268.84
mp-1185855
-6.342113
-5.605474
0.469412
other
Mg1Bi5
6
189
181.99
mp-1279
0.773344
1.596592
2.669848
other
Ta3N3
6
189
68.48
mp-1094576
-5.753231
-7.116875
3.535289
other
Li4Mg2
6
189
122.99
mp-1185091
-6.823459
-6.560527
6.371631
other
La5Mg1
6
189
208.66
mp-568683
-7.086308
-5.986394
6.185139
other
La16Al13
29
189
817.41
mp-409
-3.552272
-1.44138
-5.581852
other
Na6S6
12
189
265.21
mp-1094253
-5.768112
-3.871732
3.461635
other
Zr4Sn2
6
189
136.97
mp-977059
-8.186616
-4.212334
1.849502
other
Mg1Pd5
6
189
91.02
mp-22064
-6.137323
-1.407627
2.092208
other
Cr6As3
9
189
129.61
mp-1080778
-3.918255
-7.325014
2.058485
other
K6Re3
9
189
379.05
mp-18206
-6.928544
-1.164992
2.151775
other
Co24As12
36
189
439.13
mp-20026
-6.0941
-4.314896
3.409323
other
Pu6Co3
9
189
182.64
mp-1287
-3.616362
-1.439471
-5.397297
other
K6S6
12
189
366.88
mp-1094319
-7.281415
-9.017662
6.550289
other
Mg4Ti2
6
189
124.71
mp-1184358
-5.578509
-7.306629
4.023886
other
Eu5Mg1
6
189
232.34
mp-1094463
-8.541421
-7.213524
3.671875
other
Mg2Zn4
6
189
102.21
mp-1094189
-7.109986
-10.845447
4.828176
other
Mg5Sn1
6
189
136.32
mp-1094473
-7.439777
-10.923815
5.36785
other
Mg5Zn1
6
189
123.28
mp-1078992
-8.009895
-4.28814
3.473609
other
Th3Pt5
8
189
185.36
mp-31326
-7.046463
-9.71603
4.552025
other
Mg6In3
9
189
202.52
mp-308
11.465315
9.075341
1.679999
other
U3O8
11
189
165.18
mp-1545896
-5.626073
-5.716867
0.598853
other
Li12Sb6
18
189
350.8
mp-697068
-7.794551
-4.176777
2.461197
other
Si3Pd6
9
189
127.37
mp-1185948
-8.224892
-3.174546
2.611318
other
Mg2Pt4
6
189
92.59
mp-21167
-6.283856
-1.073153
1.17784
other
Ni6P3
9
189
97.84
mp-569278
-7.672547
-4.551774
2.592545
other
Si3Pd6
9
189
147.59
mp-553347
9.68685
8.439133
2.941249
other
La2O3
5
189
112.23
mp-1079207
10.767122
12.479198
1.199998
other
Ti3O6
9
189
77.09
mp-1024071
-6.765454
-3.672073
3.510957
other
Si3Pt6
9
189
134.17