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-636821
-5.154937
-3.703371
3.702208
other
U12Ni2
14
140
270.86
mp-1202922
-8.736807
-5.881329
6.335016
other
Tb42Rh28
70
140
1,546.51
mp-17094
-6.010015
-0.92449
3.309613
other
Ge6Mo10
16
140
240.72
mp-1105764
-5.112191
-4.577495
6.229167
other
Pr10Si6
16
140
434.85
mp-1052023
-8.088019
-10.353468
5.330894
other
Mg4Cu2
6
140
106.18
mp-637308
-7.011515
-5.86808
4.29458
other
Ce10Sn6
16
140
500.46
mp-636056
3.367958
2.856238
-3.149131
other
K2N6
8
140
256.36
mp-30368
-6.90311
-6.947287
3.534398
other
Ca10Au6
16
140
445.91
mp-569837
-5.316109
-2.969793
3.100864
other
Ti12Sb4
16
140
293.68
mp-574
-6.088627
-1.859972
3.76683
original
Ta4Co2
6
140
91.91
mp-1105942
-7.928456
-6.517857
6.428545
other
Sm10Ga6
16
140
434.96
mp-22795
-7.063889
-6.486182
2.202203
other
Pb4Au2
6
140
157.61
mp-30571
-6.307163
-6.823284
1.888044
other
Tl4Au2
6
140
153.71
mp-554175
15.591949
5.600111
0.2981
other
Si16O32
48
140
982.46
mp-2666
-6.089
-3.474017
0.86334
other
Cr2Sb4
6
140
122.95
mp-17325
-5.492082
-6.93771
3.138327
other
Ba10Sn6
16
140
712.89
mp-321
-7.195415
-5.564433
2.326157
other
Rh2Pb4
6
140
133.41
mp-17593
-5.65673
-2.07362
3.620061
other
Ta10Ge6
16
140
264.5
mp-1101251
-6.397335
-6.439466
2.341032
other
Tl4Pt2
6
140
153.23
mp-568195
-5.210551
-3.494112
3.601679
other
U12Mn2
14
140
271.9
mp-1188215
-5.693335
-2.262277
3.451303
other
Nb10Ge6
16
140
273.25
mp-1992
-6.173771
-4.169011
3.243969
other
Pu10Ru6
16
140
332.02
mp-1072256
-5.87099
-3.560208
3.938287
other
Hf4Ge2
6
140
127.38
mp-20320
-6.087609
-3.464185
-2.097675
other
In4Te4
8
140
267.39
mp-1726
6.843718
5.881143
-3.771628
other
K4O12
16
140
282.28
mp-1188446
-7.704556
-7.218131
5.989248
other
Sm10Tl6
16
140
488.85
mp-1032
-5.354278
-1.320481
3.428232
other
Ta4B2
6
140
81.72
mp-1188565
-5.767362
-5.646034
0.785372
other
In10Sb6
16
140
455.39
mp-30562
-7.877174
-4.591398
4.964874
other
Sc4Co2
6
140
111.06
mp-1188207
-6.021411
-1.634217
4.08553
other
Zr6W10
16
140
301.94
mp-2786
-5.632834
-7.302096
3.805116
other
Ca10Zn6
16
140
471.79
mp-1095578
-7.84496
-3.808484
4.536979
other
Ga10Ni2
12
140
188.95
mp-1188153
-5.973584
-2.803934
3.993583
other
Ti10Ga6
16
140
262.62
mp-1105651
-6.840285
-5.866287
3.723307
other
Ca10Pt6
16
140
389.32
mp-1363
-5.833923
-7.105245
2.593234
other
Na4Au2
6
140
149.54
mp-582635
-5.235229
-3.652357
3.666504
other
U12Co2
14
140
269.13
mp-13686
-5.511536
-2.626969
3.827454
other
Nb10Si6
16
140
259.87
mp-2848
-6.249474
-4.104716
3.108451
other
Pu10Ir6
16
140
346.75
mp-569251
-7.62562
-6.141084
5.793255
other
Lu28Sb12
40
140
1,079.63
mp-571212
-7.475022
-6.659823
3.649719
other
Yb10Ag6
16
140
459.38
mp-1219422
-5.334076
-4.380248
1.132573
other
Sc28As12
40
140
839.21
mp-13052
-3.996938
-5.762576
5.250206
other
Sr10Si6
16
140
513.33
mp-568144
-8.059697
-6.627072
5.981184
other
Dy10In6
16
140
447.73
mp-568376
-5.500798
-2.27508
3.636202
other
Ta10Ga6
16
140
266
mp-23180
-6.073142
-5.914227
0.822789
other
In10Bi6
16
140
478.18
mp-568671
-6.041348
-0.99294
3.728448
original
V10Si6
16
140
205.76
mp-1188772
-7.510485
-7.033194
5.683709
other
Tb10Tl6
16
140
464.64
mp-956
-5.082082
-3.572684
3.655953
other
U6Si2
8
140
152.42
mp-680426
-6.525657
-4.442486
2.696265
other
Pu62Pt40
102
140
2,370.8
mp-793
-4.042493
-5.50354
5.395482
original
Ca10Si6
16
140
432.79
mp-30371
-8.316085
-6.320477
2.247237
other
Cd10Au6
16
140
318.68
mp-1202141
-8.080841
-6.061467
6.257132
other
Tm24Ga16
40
140
944.25
mp-1245797
-5.241616
-4.216166
0.398288
other
Cu2As4
6
140
100.92
mp-1034
-6.47397
-5.816967
5.598841
other
Th4Cu2
6
140
153.46
mp-1278
-5.334172
-3.509684
4.321212
other
Zr4Si2
6
140
116.44
mp-1190042
-3.137674
-2.939433
-3.826433
other
U6S10
16
140
316.17
mp-31154
-6.298572
-7.488954
3.374791
other
Ca10Hg6
16
140
492.59
mp-1189187
-5.618299
-2.538192
3.410794
other
Nb12Ge4
16
140
285.48
mp-870
5.022028
3.203258
-3.414537
original
Tl2N6
8
140
140.53
mp-1188342
-7.873389
-6.163709
6.254563
other
Tb10Ga6
16
140
413.32
mp-755435
-6.201595
-6.865801
1.926678
other
Tl4Au2
6
140
160.06
mp-1098707
-4.283978
-4.969843
-3.41686
other
Ce8Se16
24
140
2,098.19
mp-568
-5.980429
-3.485608
1.803068
other
Ti2Sb4
6
140
130.2
mp-568944
-8.090988
-6.171913
3.278683
other
Yb10Au6
16
140
433.06
mp-1915
-7.155965
0.908567
3.695853
other
Fe4B2
6
140
54.83
mp-2233
-6.588282
-5.964675
5.755277
other
Th4Ag2
6
140
168.62
mp-1113
-5.573133
-0.010248
3.283358
other
B2W4
6
140
73.86
mp-1396678
9.00459
1.588074
-0.640466
other
Fe2F8
10
140
150.14
mp-30660
-7.709444
-4.534864
4.184733
other
Ga10Pd2
12
140
205.5
mp-1148
-6.55587
-5.750196
5.576424
other
Th4Pd2
6
140
159.78
mp-1189750
-8.083396
-6.614972
5.999104
other
Ho10In6
16
140
451.19
mp-13208
-8.342454
-9.170855
4.653157
other
Mg4Pt2
6
140
111.9
mp-30823
-6.344409
-4.098492
3.210384
other
Pu10Os6
16
140
333.06
mp-1120757
-6.443663
-5.145033
0.708221
other
V10Bi6
16
140
315.95
mp-1188350
-6.681792
-6.590598
3.410999
other
Yb10Sn6
16
140
503.75
mp-10961
-5.093907
-4.637828
6.034781
other
La10Si6
16
140
451.58
mp-827
4.830394
2.970478
-3.373925
other
K2N6
8
140
130.91
mp-568324
-6.359647
-1.075295
3.929568
other
Cr10Ge6
16
140
204.91
mp-20599
-6.900677
-6.061025
2.050974
other
Pd2Pb4
6
140
142.19
mp-862621
-8.039865
-2.909803
2.670686
other
Ga2Pt6
8
140
120.05
mp-1199315
-8.160195
-6.102278
6.171435
other
Lu24Ga16
40
140
916.34
mp-510557
4.678625
2.975482
-3.446292
other
Cs2N6
8
140
174.68
mp-2081
-6.008141
-3.663448
-2.286153
other
Tl8Te8
16
140
537.71
mp-2387
-6.324604
-5.931087
5.80937
other
Th4Zn2
6
140
161.78
mp-1924816
8.62094
1.815546
-0.668943
other
Cr2F8
10
140
155.23
mp-15809
-5.85752
0.109815
3.346463
other
Cr4B2
6
140
55.42
mp-565
-7.865592
-4.030051
2.816528
other
Sn4Rh2
6
140
118.61
mp-1025039
-3.207825
-1.624483
-5.539358
other
Pb2S4
6
140
142.84
mp-1105285
-6.075404
-1.173158
3.62773
other
V10Ge6
16
140
222.5
mp-12772
-5.907162
-3.547495
4.359766
other
Hf4Al2
6
140
120.94
mp-31172
-6.588641
-7.089572
3.617095
other
Ca10Ag6
16
140
475
mp-1189395
-7.697332
-7.225963
5.707776
other
Dy10Tl6
16
140
468.34
mp-554258
15.732926
5.608842
0.418658
other
Si16O32
48
140
885.68
mp-542328
-6.941928
-5.549028
5.349037
other
Ce10Ga6
16
140
398.63
mp-30666
-7.994595
-5.091616
4.980004
other
Sc24Ga16
40
140
816.37
mp-622106
-5.503113
-7.107799
3.131897
other
Ba10Pb6
16
140
731.26
mp-571664
-6.671932
-3.408088
4.021897
other
Zr4Rh2
6
140
119.49
mp-19974
-7.708519
-6.497829
2.379533
other
In4Ag2
6
140
134.37
mp-567996
-5.507999
-2.658505
3.828244
other
Nb10Si6
16
140
258.28
mp-174
-5.85746
-4.109069
-2.233183
original
Tl10Te6
16
140
526.68