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-5207
13.655383
5.851886
-7.022259
other
Sc8P24O72
104
220
1,547.21
mp-17926
-6.111202
-3.363876
1.303437
other
Zr6Ni6Sb8
20
220
375.87
mp-570621
-7.995065
-3.545687
4.854192
other
V8Ga32Cu12
52
220
800.31
mp-1188905
-5.934701
-3.776511
1.128019
other
U6Co6Sb8
20
220
404.46
mp-1208030
-6.150691
-4.430484
0.925808
other
U6Ni6Bi8
20
220
441.31
mp-1209761
-6.391229
-5.031832
0.991557
other
Pr6Ni6Bi8
20
220
482.26
mp-971830
-6.1187
-3.876189
1.178576
other
U6Sb8Rh6
20
220
439.91
mp-1105594
-5.81457
-4.7963
0.855952
other
La6Cu6Sb8
20
220
483.81
mp-1207448
-6.605103
-3.577318
1.236979
other
Zr6Sb8Pt6
20
220
421.2
mp-1105252
-6.499251
-5.450008
0.869006
other
Pr6Bi8Au6
20
220
550.65
mp-1189199
-6.333456
-4.669758
0.917589
other
Lu6Sb8Au6
20
220
466.81
mp-1106363
-6.396323
-4.587013
0.826067
other
Ho6Sb8Au6
20
220
478.78
mp-1210067
-6.184346
-5.53779
1.193034
other
Nd6Cu6Bi8
20
220
493.74
mp-567905
-7.507494
-4.029367
3.558722
other
U6Ni6Sn8
20
220
407.58
mp-8331
-4.118612
-5.52259
5.136414
other
Li24Mg6Si8
38
220
609.93
mp-707454
8.761711
1.106338
-3.862211
other
Li8H96N32
136
220
1,561.09
mp-1105333
-6.524257
-5.405123
0.905698
other
La6Bi8Au6
20
220
561.22
mp-1189617
-5.770238
-4.704072
0.83725
other
Gd6Cu6Sb8
20
220
451.93
mp-1212692
11.37996
7.43058
-1.634844
other
Ge24N8O48
80
220
1,329.23
mp-1212125
10.293981
10.606934
-3.920962
other
La8Mo18O72
98
220
1,650.72
mp-1189165
-5.845592
-4.531237
0.919102
other
Ce6Cu6Sb8
20
220
460.14
mp-984350
-6.29608
-4.670259
0.807918
other
Dy6Sb8Au6
20
220
482.23
mp-3435
-5.796913
-4.673983
0.805782
other
Nd6Cu6Sb8
20
220
463.69
mp-1105695
-6.302404
-4.713335
0.882214
other
Er6Sb8Au6
20
220
486.45
mp-1209812
11.78696
6.537803
-5.317746
other
P6Pb8O24
38
220
566.93
mp-1189990
-5.946816
-3.987977
1.154848
other
U6Sb8Pd6
20
220
461.21
mp-582142
-6.491783
-4.867533
0.851253
other
Ce6Bi8Pd6
20
220
502.51
mp-769052
10.119833
6.877029
-2.884437
other
Bi8B6O24
38
220
470.31
mp-1195261
8.257045
2.003581
-0.649403
other
Ag6Sb8F48
62
220
1,021.07
mp-1188604
-6.050434
-3.857079
1.249691
other
U6Sb8Pt6
20
220
464.82
mp-1106051
-5.851917
-4.642508
0.904299
other
Y6Cu6Sb8
20
220
437.93
mp-23560
10.993527
7.772572
-1.583519
other
Ge6Bi8O24
38
220
579.87
mp-1190030
-6.265259
-4.814947
0.792054
other
La6Sb8Au6
20
220
531.1
mp-567502
-7.543642
-2.947392
4.92775
other
Ga32Cu12Mo8
52
220
867.18
mp-1209333
-6.624523
-4.803681
0.899054
other
Pr6Bi8Pt6
20
220
525.8
mp-13654
-6.322388
-4.686523
0.835131
other
Y6Sb8Au6
20
220
485.73
mp-23331
11.622338
7.298025
-1.605058
other
Si6Bi8O24
38
220
541.27
mp-568017
-7.572009
-2.76127
4.82825
other
Ga32Cu12W8
52
220
845.15
mp-721592
12.272058
7.404045
0.987612
other
Ca12Al14O32
58
220
864.89
mp-1105777
-6.094383
-3.678714
1.223555
other
U6Sb8Ir6
20
220
444.01
mp-1188981
-6.513305
-4.637174
0.967288
other
Tm6Sb8Au6
20
220
471.98
mp-1105587
-6.547099
-5.275555
1.000087
other
Ce6Bi8Au6
20
220
552.72
mp-1188547
-5.92011
-4.548937
0.970587
other
Tb6Cu6Sb8
20
220
437.46
mp-1200701
6.888978
8.464621
-2.781465
other
Ca12Al8O48
68
220
1,095.79
mp-1211407
-6.484764
-4.891333
1.08656
other
La6Ni6Bi8
20
220
493.12
mp-504640
-5.751919
-3.898188
1.104943
other
U6Ni6Sb8
20
220
417.84
mp-28708
13.917442
7.117453
-5.435433
other
In12P8O32
52
220
695.07
mp-1207589
-6.057081
-5.079042
0.786432
other
Yb6Sb8Au6
20
220
509.33
mp-979979
-6.257844
-4.697476
0.730285
other
Sm6Sb8Au6
20
220
500.66
mp-1189135
-5.91157
-4.670044
0.896084
other
Dy6Cu6Sb8
20
220
433.92
mp-1188816
-7.673306
-4.444273
3.375347
other
U6Sn8Au6
20
220
486.6
mp-1188599
-6.295779
-4.679476
0.769617
other
Gd6Sb8Au6
20
220
500.76
mp-1208010
10.245513
11.568076
-3.346706
other
V6Pb8O24
38
220
626.65
mp-568158
-7.719649
1.107135
4.733105
other
Nd8Fe92B12
112
220
1,394.47
mp-1189173
-6.616785
-4.844608
0.901595
other
La6Bi8Pt6
20
220
540.83
mp-1188666
-5.766668
-4.745986
0.768689
original
Sm6Cu6Sb8
20
220
451.18
mp-1214289
12.996405
7.330719
-4.324739
other
Bi8P6O24
38
220
560.65
mp-1189639
-7.543068
-4.69898
3.625161
other
Th6Ni6Sn8
20
220
450.64
mp-1210154
-6.456419
-4.940233
1.055461
other
Nd6Ni6Bi8
20
220
475.78
mp-14378
-4.233159
-5.485091
5.283789
other
Li24Al6Si8
38
220
582.21
mp-1105827
-5.795661
-4.709171
0.776385
other
Pr6Cu6Sb8
20
220
470.64
mp-1105400
-6.498381
-5.399787
0.902619
other
Nd6Bi8Au6
20
220
542.89
mp-1105893
-6.270501
-5.490032
1.214597
other
La6Cu6Bi8
20
220
512.51
mp-1105248
-6.518323
-5.456709
0.892248
other
Sm6Bi8Au6
20
220
531.12
mp-1105663
-6.389401
-4.051165
0.744496
other
Pr6Sb8Pt6
20
220
497.45
mp-1198201
13.472213
5.797419
-6.832685
other
Lu8P24O72
104
220
1,630.6
mp-1198549
9.131438
9.881537
0.31869
other
Mn32Bi32O90
154
220
2,098.44
mp-1189310
-5.943588
-4.562512
0.987455
other
Ho6Cu6Sb8
20
220
436.97
mp-1207678
-6.294086
-4.257556
0.806394
other
U6Bi8Rh6
20
220
471.25
mp-1188608
-6.329987
-3.995131
0.794466
other
Ce6Sb8Pt6
20
220
475.28
mp-14011
13.229383
6.402664
-7.244239
other
Al8P24O72
104
220
1,350.55
mp-22708
-5.993269
-3.999335
1.022873
other
Th6Co6Sb8
20
220
447.16
mp-1188951
-5.796718
-3.963231
1.18545
other
U6Cu6Sb8
20
220
423.88
mp-861503
-6.232914
-4.68539
0.713815
other
Pr6Sb8Au6
20
220
519.32
mp-1189666
-7.416068
-4.516121
3.668554
other
U6Cu6Sn8
20
220
434.76
mp-1212441
-6.29388
-3.302066
1.378054
other
Hf6Ni6Sb8
20
220
368.36
mp-1189480
-7.379804
-4.040993
3.186978
other
U6Sn8Pt6
20
220
463.82
mp-1202854
11.123674
10.621849
-0.689902
other
Pr20Mo12O64
96
222
1,408.27
mp-558671
11.193856
10.554526
-0.552235
other
Nd20Mo12O64
96
222
1,381.64
mp-36033
8.554143
1.996547
2.438771
other
Pr1O1F1
3
216
46.45
mp-30818
-7.805545
-5.056213
3.709909
other
Li2Al1Pt1
4
216
54.06
mp-962068
-5.846675
-7.085182
3.211897
other
Ca1Mg1Sn1
3
216
86.49
mp-1209682
-7.772592
-6.756171
6.844561
other
Pr16Cd4Pd4
24
216
722.57
mp-1221566
-6.874085
-2.039789
1.398548
other
Mn1Ni2Sb1
4
216
54.97
mp-12718
-6.941486
-6.336695
4.199431
other
Li1Pr1Sn1
3
216
78.02
mp-30806
-6.38481
-3.739879
3.323582
other
Zr1Ni1Sn1
3
216
64.39
mp-30452
-6.402257
-4.82735
1.076657
other
Dy1Ni1Bi1
3
216
66.58
mp-1209865
-1.416254
0.580623
-3.603771
other
Nb4Se4Br4
12
216
292.4
mp-31459
-6.261805
-2.721992
1.617331
other
Ta1Co1Sb1
3
216
53.16
mp-1216949
-7.282159
-3.533782
3.252283
other
Ti1Co1Sn1
3
216
52.69
mp-1222615
-6.289617
-7.004535
2.888942
other
Li2Mg1Sn1
4
216
76.84
mp-999052
-6.185062
-2.1359
4.408166
other
Ti2Mn1Al1
4
216
60.96
mp-30344
-7.078606
-6.998833
3.099796
other
Li2In1Ag1
4
216
69.91
mp-1224547
-7.598994
-4.510031
3.08227
other
Ho5Sn18Rh6
29
216
685.04
mp-31142
-6.384481
-5.811684
1.028882
other
Yb1Bi1Au1
3
216
89.03
mp-1212306
-8.450421
-6.445103
6.385374
other
Ho16Cd4Pt4
24
216
622.82
mp-546633
6.617247
5.807209
-3.379753
other
K1Cl1O4
6
216
100.13
mp-631496
-0.828971
0.841493
-1.631815
other
Be2Re1Cl1
4
216
49.82
mp-1227030
-6.778143
-4.782253
6.027817
other
Ca1Sm1Al4
6
216
127.53
mp-961722
-6.645964
-4.058068
1.048056
other
Ti1Bi1Rh1
3
216
63.99