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-8768
-4.838785
-2.878542
-3.863518
other
K4Co2Se4
10
72
291.24
mp-1213960
-7.640471
-3.533633
4.643407
other
Ce4Ni6Ge10
20
72
339.6
mp-1208907
-5.202458
-3.296961
6.103673
other
Sm4Si10Rh6
20
72
333.92
mp-1188138
-7.919005
-2.332749
5.28576
other
Er4Ge10Ru6
20
72
352.25
mp-1180782
9.473273
1.943997
1.995802
other
K2Cr2F6
10
72
144.41
mp-1013730
-3.944202
-1.439979
-5.626153
other
Cd10S8Cl4
22
72
618.96
mp-1246171
1.789019
1.707431
1.391178
other
Ca14Zr2N12
28
72
493.16
mp-1246442
2.36119
2.154329
1.607941
other
Mg14Si2N12
28
72
325.56
mp-1209921
-5.06371
-3.677047
5.695257
other
Nd4Si10Ni6
20
72
320.12
mp-568336
-5.453188
-2.999496
5.951038
other
Lu4Si10Ir6
20
72
322.76
mp-8932
-3.555002
-4.448328
0.761854
other
Cs4Si2P4
10
72
334.56
mp-1213767
8.612633
1.470794
1.417904
other
Ce2Zr4F22
28
72
451.72
mp-1192266
-6.186551
-1.933079
4.324231
other
Ti8Cr4Ge10
22
72
327.29
mp-1106079
-5.261824
-3.079526
5.792564
other
Tb4Co6Si10
20
72
301.59
mp-18678
-8.01965
-3.137438
4.600556
other
Nd4Ge10Rh6
20
72
367.04
mp-554610
8.524832
1.406388
1.312294
other
Pr2Zr4F22
28
72
432.22
mp-14245
-5.244734
-3.22972
6.096173
other
Dy4Si10Rh6
20
72
331.08
mp-6960
-4.565392
-5.365503
0.364596
other
Rb4Si2As4
10
72
325.36
mp-1209873
8.546443
1.364827
1.315202
other
Nd2Hf4F22
28
72
417.41
mp-1187808
-5.205403
-3.212453
5.867181
other
U4Si10Rh6
20
72
330.93
mp-774256
10.424026
10.624486
0.338548
other
Na8Mn4O8
20
72
291.2
mp-6984
-4.572582
-5.318511
0.38767
other
K4Si2As4
10
72
296.89
mp-1212876
-5.260196
-3.166915
5.999779
other
Er4Si10Rh6
20
72
321.71
mp-2884
-4.419271
-1.409822
-5.24881
other
Cs4Mn6S8
18
72
500.57
mp-4052
-4.980844
-2.866342
-3.733948
other
Rb4Mn6Se8
18
72
523.83
mp-1183797
-5.105479
-3.560947
5.615618
other
Ce4Si10Ni6
20
72
311.56
mp-1106369
-7.921887
-3.135948
4.555605
other
Ce4Ge10Rh6
20
72
371.5
mp-12535
-5.970426
-3.583894
-2.072627
other
K4Zn2Te4
10
72
356.92
mp-1390771
10.170264
1.531537
1.600079
other
Zn2Fe2F8
12
72
140.06
mp-1147773
-3.751127
-1.671641
-5.608455
other
K4Zn2S4
10
72
261.8
mp-1191280
-5.636068
-2.2123
4.178709
other
Nb8V4Si10
22
72
323.39
mp-1106159
-5.1932
-4.005435
5.188976
other
Pr4Si10Pt6
20
72
361.36
mp-8257
-3.83237
-1.660581
-5.740585
other
Na4Zn2S4
10
72
207.86
mp-3257
-4.344101
-2.115813
-3.521901
other
K4Au4Se20
28
72
891.96
mp-1247353
1.891055
1.835901
1.263078
other
Ca14Te2N12
28
72
479.94
mp-754776
-7.881567
-2.375317
5.322561
other
Sm4Ge10Ru6
20
72
357.95
mp-1188596
-5.121912
-3.501703
5.612826
other
Er4Si10Ni6
20
72
298.29
mp-1105776
-4.443605
-1.385884
-5.237729
other
Rb4Mn6S8
18
72
468.21
mp-1103948
-2.666554
0.576076
2.56045
original
Ho4Fe2C8
14
72
176.36
mp-1190128
-7.998849
-2.844261
4.736291
other
Dy4Ge10Ir6
20
72
366.66
mp-1182108
4.505259
2.765778
-3.512506
other
C8N4Cl4
16
72
402.13
mp-1246928
1.617082
1.69772
1.289797
other
Sr14Pb2N12
28
72
589.09
mp-1541753
9.398969
8.578168
0.211508
other
Rb8Mg4O8
20
72
379.72
mp-15205
-5.067061
-3.570612
5.627896
other
Dy4Si10Ni6
20
72
296.13
mp-620812
-7.886017
-2.401797
5.378508
other
Y4Ge10Ru6
20
72
350.63
mp-1446098
9.703563
1.723937
1.667505
other
Mg2Cr2F8
12
72
137.63
mp-12464
-5.194426
-1.788976
-3.092344
other
Co2Pd4Se4
10
72
160.4
mp-1024069
-4.175262
-1.656514
-6.169696
other
Na4Zn6S8
18
72
381.96
mp-1208891
-5.191826
-4.053521
5.311303
other
Sm4Si10Pt6
20
72
346.62
mp-1079891
7.862987
7.307997
-0.254291
other
Ba4Br4O2
10
72
323.72
mp-1219258
-6.072315
-0.880837
3.454507
other
Si6Mo6W4
16
72
232.09
mp-8716
-4.888397
-3.021718
-3.85991
other
K4Mn2Se4
10
72
305.51
mp-1188584
-7.965817
-2.650223
5.103504
other
Ce4Co6Ge10
20
72
334.12
mp-983234
-7.959498
-2.894369
4.712544
other
Sm4Ge10Ir6
20
72
365.42
mp-569796
-5.815379
-1.948606
4.731653
other
Nb4Cr8Si10
22
72
312.75
mp-1247110
1.603954
1.772007
1.344311
other
Sr14Pt2N12
28
72
554.22
mp-1209557
8.540042
1.35985
1.345098
other
Pr2Hf4F22
28
72
422.72
mp-573721
-4.60498
-5.35718
0.395302
other
Cs4Si2As4
10
72
361.69
mp-1045307
10.058862
1.258591
1.699028
other
Mg2Fe2F8
12
72
130.89
mp-1188586
-7.901521
-2.427295
5.307909
other
Pr4Ge10Ru6
20
72
370.81
mp-15206
-5.115566
-3.507213
5.589411
other
Ho4Si10Ni6
20
72
299.19
mp-1178612
12.848082
6.381768
-0.984833
other
Zn4Si4O12
20
72
271.8
mp-1208248
-5.901942
-1.453749
4.45527
other
Ti4Cr8Si10
22
72
275.32
mp-3592
-2.729348
-0.592633
-5.032131
other
K4Au4S20
28
72
716.7
mp-27227
8.829875
9.042197
-0.96629
other
Li2Ag6O4
12
72
167.58
mp-505630
-5.890165
-1.9756
4.706938
other
Ta4Cr8Si10
22
72
312.8
mp-1187284
-5.424236
-2.974521
5.929324
other
Tb4Si10Ir6
20
72
335.37
mp-31125
-5.880694
-1.801463
4.829347
other
Zr4Cr8Si10
22
72
304.13
mp-29645
-5.924051
-1.524202
4.50968
other
Nb4Cr8Si10
22
72
287.38
mp-8766
-3.949494
-1.458998
-5.348373
other
Rb4Co2S4
10
72
284.92
mp-755654
9.225414
10.037703
-1.037143
other
Na2Sb6O16
24
72
279.55
mp-1179796
-4.992821
-0.90935
-4.439389
other
Rb4Co6S8
18
72
375.22
mp-1222501
8.235415
14.742419
-0.837997
other
Li2Mn4O8
14
72
136.24
mp-621659
-7.932854
-2.94139
4.733093
other
La4Ge10Ir6
20
72
379.01
mp-1246105
1.862743
1.782822
1.292233
other
Ca14Sn2N12
28
72
482.96
mp-8620
-5.209649
-3.413507
6.029783
other
La4Si10Rh6
20
72
349.93
mp-1101326
11.061612
11.725154
2.747342
other
Ta6Ag2O16
24
72
274.4
mp-1021465
-4.840253
-3.107086
-4.008806
other
Na4Zn2Se4
10
72
235.39
mp-16478
-5.528239
-2.688103
5.961371
other
Tb4Si10Ru6
20
72
325.41
mp-541894
-7.861397
-2.677567
5.211858
other
Pr4Co6Ge10
20
72
348.32
mp-1079951
-4.932996
-2.715365
-3.771695
other
Na4Co2Se4
10
72
228.4
mp-675489
-4.695695
-6.131436
3.103043
other
Ba6Ge8C4
18
72
603.04
mp-1104515
-2.669205
0.554431
2.5947
other
Lu4Fe2C8
14
72
170.61
mp-28661
-3.513504
-4.230378
0.858774
other
Ba4Cu6P8
18
72
360.36
mp-9634
-3.907561
-1.671141
-5.381527
other
Na6Ag2S4
12
72
275.87
mp-1208894
-5.255706
-4.171988
5.323669
other
Sm4Si10Pd6
20
72
345.62
mp-510122
-6.064166
-4.35051
3.35498
other
Ce2Pu8Co6
16
72
307.76
mp-23358
8.911396
8.660532
-1.695889
other
Hg10Cl4O8
22
72
426.83
mp-1105812
-7.898265
-2.340005
5.405438
other
Dy4Ge10Ru6
20
72
357.87
mp-1216681
-6.255424
-1.001508
3.93415
other
V4Cr6Si6
16
72
197.08
mp-551835
-0.838904
1.859544
-1.761161
other
Ba4I4O2
10
72
370.33
mp-1190062
-5.298096
-3.030923
5.817156
original
Er4Co6Si10
20
72
287.72
mp-505034
-4.104834
-1.617736
-5.254509
other
Cs4Mn2S4
10
72
334.57
mp-551203
-0.971505
1.900417
-2.129972
other
Sr4I4O2
10
72
322.55
mp-1105794
-5.214147
-4.028298
5.238506
other
Pu4Si10Pt6
20
72
343.6
mp-8235
-3.481388
-4.342913
0.748217
other
K4Si2P4
10
72
271.88
mp-1188238
-7.993989
-2.862066
4.69133
other
Tb4Ge10Ir6
20
72
367.98
mp-14532
10.981793
11.730958
2.884068
other
Na2Ta6O16
24
72
272.5
mp-655353
5.550014
3.321075
-4.663321
other
Ru2C8O8
18
72
307.34
mp-1189601
-5.136947
-3.518827
5.550277
other
Tm4Si10Ni6
20
72
296.04