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-1103568
-7.300242
0.119547
5.011185
other
Tm2Fe8Ge4
14
136
195.67
mp-773516
6.811535
12.522159
-1.161667
other
Li12Ni4O12
28
136
279.47
mp-754224
-1.261457
1.94902
-1.642028
other
Ba2Sr4I12
18
136
937.59
mp-755591
9.909163
9.368004
0.290922
other
Dy4Te2O12
18
136
252.51
mp-1105850
-8.907833
-6.430202
3.179651
other
Y8Sn4Au8
20
136
479.97
mp-1104140
-5.979294
-1.236146
0.849462
original
Tm2Ni8P4
14
136
176.81
mp-752397
-1.299634
1.92375
-1.568683
other
Ba4Sr2I12
18
136
998.08
mp-567900
-7.667655
1.007731
4.954941
other
Lu8Fe56C4
68
136
875.77
mp-755193
9.687853
0.712738
-0.315207
other
Li4Fe2F12
18
136
184.37
mp-770883
7.365654
10.158545
-1.023138
other
K8Co4O10
22
136
524.69
mp-1212691
-8.196773
-4.76646
3.361239
other
Hf8In4Pd8
20
136
375.76
mp-1209388
-8.877693
-5.969548
3.444421
other
Sc8In4Au8
20
136
405.52
mp-1196278
-7.703971
1.049661
5.081186
other
Sm8Fe56C4
68
136
901.38
mp-1246922
1.649258
1.829756
1.237129
other
Ca22Rh4N20
46
136
814.23
mp-10480
-4.520125
-2.767531
-4.066618
other
Cs4Ag20Se12
36
136
919.8
mp-755853
5.982124
9.023471
-1.665235
other
Hg2Bi4O12
18
136
259.72
mp-1188895
-8.98524
-6.428875
3.240711
other
Ho8Sn4Au8
20
136
469.95
mp-13985
8.95165
1.151945
-0.349492
other
Li4Pd2F12
18
136
189.32
mp-616958
-7.662513
0.883073
5.134974
other
Nd8Fe56B4
68
136
949.28
mp-753785
8.556825
2.087408
0.358764
other
Nb4O4F12
20
136
338
mp-642735
3.210937
-0.635218
-2.319667
other
Rb4H8Pt2
14
136
288.79
mp-510366
8.61181
9.848736
0.091126
other
K12Co4O10
26
136
530.5
mp-510040
-7.241653
-3.205076
3.529784
other
Zr8Ni8Sn4
20
136
346.6
mp-28573
-0.923523
2.023321
-3.276057
other
W4I12O4
20
136
756.64
mp-567623
-7.693769
0.995977
4.966046
other
Er8Fe56C4
68
136
884.68
mp-768291
9.765855
9.946163
-1.238862
other
Hg2Sb4O12
18
136
237.91
mp-1104519
-6.394555
-1.953394
1.08003
other
Tm2Ni8As4
14
136
190.85
mp-4023
-7.740564
1.065087
5.02744
other
Dy8Fe56B4
68
136
906.91
mp-1199650
-7.694586
1.016099
5.073312
other
Nd8Fe56C4
68
136
918.31
mp-1219152
11.092175
11.174391
-1.429848
other
Re4Ni2O12
18
136
192.53
mp-21437
8.745341
12.711138
-1.600307
other
Fe4Te2O12
18
136
174.39
mp-1188482
-9.089519
-6.437168
3.822183
other
Tm8In4Au8
20
136
433.71
mp-27463
9.507505
0.50099
0.606877
other
Na10Fe6F28
44
136
613.48
mp-778668
13.035502
0.636099
1.854015
other
Fe6O4F8
18
136
212.04
mp-1209123
9.494584
11.716276
-1.129405
other
Rh4W2O12
18
136
203.02
mp-1197631
-8.801432
0.098152
4.521404
other
La8Co56B4
68
136
884.62
mp-31143
-8.972638
-6.404177
3.222428
other
Er8Sn4Au8
20
136
465.07
mp-568580
-5.785705
-7.051746
2.928603
other
Na40Ga24Sn12
76
136
1,938.5
mp-1104964
-6.42606
-1.982029
1.052133
other
Lu2Ni8As4
14
136
189.45
mp-1104658
-5.429977
-1.22451
4.048426
other
Sm2Re8Si4
14
136
227.19
mp-1200902
8.942428
11.331408
0.810502
other
Sr8Fe12O24
44
136
618.57
mp-1207910
-7.37794
0.105856
5.061292
other
Y2Fe8Ge4
14
136
209.93
mp-5434
-7.716751
1.059506
5.025457
other
Y8Fe56B4
68
136
911.23
mp-755374
9.898007
9.371032
0.302509
other
Sm4Te2O12
18
136
267.32
mp-1105063
-6.225034
-0.403737
2.215935
other
Zr2Fe8P4
14
136
172.41
mp-505597
-5.947742
-1.237235
0.815801
other
Tb2Ni8P4
14
136
178.54
mp-510133
-6.192547
-0.392935
2.00657
other
Sc2Fe8P4
14
136
183.42
mp-755567
5.839989
12.39612
-2.448035
other
Fe6O8F4
18
136
199.99
mp-1245742
1.676903
1.736242
1.341606
other
Sr22C4N20
46
136
934.86
mp-1104272
-6.000231
-1.233544
0.816688
other
Lu2Ni8P4
14
136
175.96
mp-5759
-7.721166
1.027076
5.034398
other
Tb8Fe56B4
68
136
910.43
mp-1104069
-6.434396
-1.928591
1.006671
other
Y2Ni8As4
14
136
194.22
mp-1104117
-7.669299
-5.992635
2.751288
other
Sr2Cd8Pt4
14
136
308.78
mp-765413
8.743623
0.952036
-0.464668
other
Li4Ag2F12
18
136
199.16
mp-1209130
-8.509237
-5.049496
3.750473
other
Sc8In4Pd8
20
136
381.75
mp-21241
11.000072
12.437801
-1.468902
other
Cr4Re2O12
18
136
194.69
mp-3188
9.699265
10.162261
-0.826015
other
Zn2Sb4O12
18
136
203.59
mp-756339
9.993872
9.426517
0.513706
original
Tm4Te2O12
18
136
243.73
mp-9206
-5.989592
-3.193064
-2.621926
other
Cs4Ag20Te12
36
136
1,008.05
mp-541923
-5.360589
-2.93427
-4.554479
other
Tl4Cu20Se12
36
136
659.43
mp-1210890
-7.950821
-0.953117
4.478229
other
Lu2Co8Ge4
14
136
191.55
mp-761827
7.897678
10.027323
-0.164505
other
Na12Cu4O12
28
136
364.6
mp-674382
7.680429
5.445373
-2.998387
other
Na12N4O8
24
136
394.81
mp-31258
-2.942971
0.548641
2.685571
other
Pr8Mo4C8
20
136
358.79
mp-3501
-7.357363
0.052523
5.019185
other
Er2Fe8Ge4
14
136
201.18
mp-1103784
-6.384608
-1.999954
0.908383
other
Tb2Ni8As4
14
136
194.49
mp-1200780
-7.674963
0.988004
5.089228
other
Pr8Fe56C4
68
136
921.78
mp-1214261
-6.866433
-6.635561
2.007403
other
Bi4Pb12Au4
20
136
596.32
mp-4164
-8.758904
0.082649
4.45628
other
Nd8Co56B4
68
136
869.29
mp-1226109
11.760648
11.317626
-0.724568
other
Cr4Re8O24
36
136
390.14
mp-32308
11.02579
11.931705
2.339605
other
Ta4Ni2O12
18
136
203.48
mp-780777
9.984345
14.971963
-1.430308
other
Mn6O8F4
18
136
198.61
mp-1196806
-7.758362
1.056473
4.950329
other
Yb8Fe56B4
68
136
902.64
mp-1102898
8.663948
9.724549
-0.12276
other
K6Ni2O4
12
136
263.16
mp-1246777
2.351383
2.347699
1.235474
other
Sn22C4N20
46
136
896.72
mp-756112
6.342158
9.956264
-2.013136
other
Co4Bi8O24
36
136
450.05
mp-774745
-4.327741
-1.270683
-5.677658
other
Li12Cu4S12
28
136
522.55
mp-1101261
9.970601
13.559522
-2.51551
other
V2Cr4O12
18
136
183.62
mp-20312
12.658194
12.270568
-1.307382
other
V4W2O12
18
136
190.71
mp-1196092
-8.710423
0.122226
4.437409
other
Tb8Co56B4
68
136
858.08
mp-770737
10.310922
11.62131
-2.364397
other
Ga4W2O12
18
136
195.66
mp-1247000
1.416451
1.783147
1.324854
other
Ca22Re4N20
46
136
834.05
mp-28447
5.782016
8.996962
-1.799983
other
Mg2Bi4O12
18
136
231.32
mp-1207464
6.223144
9.139718
-2.091321
other
Zn4Bi2O12
18
136
225.25
mp-1246379
1.618851
1.873905
1.195364
other
Ca22Ir4N20
46
136
829.22
mp-755401
8.696933
9.434512
-0.129657
other
Na12Cu4O8
24
136
397.18
mp-11340
-6.473969
-1.933469
1.016777
other
Dy2Ni8As4
14
136
193.49
mp-20048
-5.901375
-1.280348
0.935537
other
U2Ni8P4
14
136
179.62
mp-5831
9.496037
10.604555
-1.269934
other
Cu2Sb4O12
18
136
200.7
mp-505271
9.562996
10.839349
-1.200611
other
Ni4Sb8O24
36
136
400.29
mp-571165
-7.719704
1.028869
5.024385
other
Dy8Fe56C4
68
136
891.82
mp-21908
9.486732
11.250863
-1.064808
other
Co4Sb8O24
36
136
404.42
mp-728614
1.07802
2.280232
-3.941182
other
Pt2I8O4
14
136
361.3
mp-757118
11.012896
-0.266513
0.774451
other
Li2Mn4F12
18
136
215.65
mp-16066
-6.163252
-1.349911
0.806204
other
Yb2Ni8P4
14
136
178.31
mp-1245712
1.794866
1.875982
1.139563
other
Ca22Te4N20
46
136
861.12
mp-1212389
-7.329948
0.01446
5.039818
other
Ho2Fe8Ge4
14
136
203.4
mp-1103360
8.403732
9.417324
-0.232338
other
Rb6Ni2O4
12
136
304.06
mp-1226583
11.282414
11.196227
-1.4349
other
Co2Re4O12
18
136
193.72
mp-1104929
-6.938507
0.057574
4.63034
other
Sc2Fe8Si4
14
136
178.41