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-676362
7.686378
6.436514
-3.474946
other
H4I4O16
24
14
305.5
mp-5040
10.340383
9.222713
-2.002882
other
Ca4Te8O20
32
14
543.37
mp-23705
3.476242
-0.671738
-2.469818
other
Na6Al2H12
20
14
221.45
mp-5081
-3.44481
-2.259284
-5.789073
other
Sm4Cu4S8
16
14
309.32
mp-752711
-1.232796
1.954749
-1.653467
other
Ba4Sr8I24
36
14
1,620.15
mp-1041001
8.279542
9.295798
-3.072649
other
Cu8Sb8O32
48
14
684.15
mp-28990
10.290514
9.130023
-2.032189
other
Bi8Te16O44
68
14
1,048.14
mp-14817
13.122062
6.472562
-6.760307
other
Pr4P20O56
80
14
1,043.88
mp-1195015
11.866746
8.911913
1.437314
other
Ce8As8O24
40
14
582.72
mp-15380
8.132757
2.070795
-0.665856
other
Sb36Se16F156
208
14
3,827.63
mp-648414
-3.348904
-0.135359
-4.956728
other
V16P8S80
104
14
2,399.03
mp-725927
10.129073
9.229042
-0.280455
other
Ba4Sb12O24
40
14
754.32
mp-30143
7.647995
6.574128
-3.253186
other
U2I4O16
22
14
347.59
mp-14679
8.502394
9.955306
0.140888
other
K28Fe8O26
62
14
1,152.64
mp-1211278
7.327106
7.226471
-4.215913
other
Mg4S4O32
40
14
604.56
mp-4661
8.89606
2.027497
2.237418
other
Sc4O4F4
12
14
138.25
mp-1195097
8.531723
1.466249
-4.081517
other
Mn2H60N32
94
14
922.99
mp-1183033
8.33426
6.521976
-5.456758
other
Ag16S16O64
96
14
1,278.97
mp-30216
-1.145032
2.628751
-2.936214
other
K4Re2I12
18
14
762.37
mp-777978
8.356745
1.126222
1.822886
other
Ba8Y8F40
56
14
994.23
mp-1193826
7.453926
7.98132
-3.657219
other
Cd2P4O20
26
14
384.63
mp-752591
7.397233
5.228851
-5.069276
other
Ni4C4O16
24
14
262.59
mp-1205339
9.395082
7.096287
-3.712718
other
Ge2Se4O12
18
14
253.46
mp-1042498
9.43093
9.660992
-2.453439
other
Co8Te16O56
80
14
1,276.24
mp-1019377
13.184012
6.226232
-7.050266
other
Al4P12O36
52
14
724.13
mp-30977
6.493705
0.421862
-3.401994
other
B40H48Br8
96
14
1,123.3
mp-1209718
1.390741
2.527126
-5.821123
other
Rb8Pb4Cl20
32
14
1,108.32
mp-1019741
15.191166
5.616653
-0.354129
other
He8Si8O16
32
14
402.24
mp-1181977
7.593023
9.313684
-1.212191
other
Ca4Ti8O24
36
14
470.61
mp-1208912
7.745853
9.062665
-0.128675
other
Sm4Ta4O18
26
14
370.49
mp-1226039
-6.205624
-2.33055
-0.874811
other
Co2Ni2Te8
12
14
256.4
mp-756334
9.125692
8.663201
0.806316
other
K4Sr4O6
14
14
320.67
mp-1209565
-0.149137
0.795079
-3.432088
other
Rb4Sm8Br20
32
14
1,060.58
mp-10772
12.893693
7.334459
-3.835891
other
Ce4As4O16
24
14
336.27
mp-1020739
5.339833
3.436081
-3.631892
other
P4S4N36
44
14
828.56
mp-1246556
0.753278
2.174123
1.901327
other
Sr4V4N8
16
14
245
mp-1003315
8.387808
14.676636
-1.455308
other
Li4Mn16O32
52
14
586.67
mp-726347
8.10651
2.320755
-1.181627
other
Be4N4F12
20
14
336.11
mp-558464
7.363551
6.813759
-3.447457
other
Yb4I12O36
52
14
814.07
mp-1197061
-2.843248
-2.422168
-5.862944
other
Nd8Si4S20
32
14
864.9
mp-1043318
12.795579
8.868212
-1.61818
other
Ge8Mo4O24
36
14
520.24
mp-756298
10.701118
12.279186
0.323754
other
Li4Mn4O6
14
14
162.09
mp-27146
-3.534814
-1.391221
-5.168574
other
Cs8Sb16S28
52
14
1,663.53
mp-18391
12.302136
6.64603
0.332556
other
Sm8Si8O28
44
14
547.69
mp-29330
9.245228
1.813805
-1.25678
other
K8H20F28
56
14
653.39
mp-1105811
8.124694
11.904204
1.722494
other
Sc4Mn4O12
20
14
218.74
mp-29164
6.109184
8.787345
-0.152204
other
Sr4Bi4O12
20
14
311.2
mp-1047059
7.824941
9.947517
-3.437306
other
Cr2Ir2O12
16
14
181.43
mp-557132
8.506493
2.597384
-1.126056
other
Os8O12F28
48
14
653.83
mp-26572
10.402724
8.21432
-6.829219
other
Cr4P8O28
40
14
490.45
mp-1104057
6.834954
4.239217
-5.178289
other
Cu2C4O8
14
14
228.61
mp-1179426
8.122952
2.183347
-0.617926
other
Ti16N16F80
112
14
2,106.58
mp-768921
14.059423
5.726935
-2.186222
other
Li32B8O28
68
14
536.66
mp-1208773
-0.131716
0.984579
-3.928585
other
Sr8Tl4Br20
32
14
1,047.62
mp-1191211
11.685198
13.378118
-1.914571
other
Ti4V4O16
24
14
266.22
mp-771174
13.362269
4.66716
-1.519533
other
Ba8B8O20
36
14
570.38
mp-1213419
11.399406
6.183768
-3.497334
other
Cu12B4O20
36
14
356.34
mp-1209030
-0.98066
1.41152
-1.690444
other
Sm8Tl4I20
32
14
1,170.18
mp-574486
4.722503
2.205207
-2.965932
other
Ag8C4N8
20
14
298.76
mp-7198
-3.860651
-2.447085
-3.403755
other
Sr4P4Se12
20
14
548.33
mp-5045
-3.540632
-1.411036
-5.782472
other
Sn4Ge4S12
20
14
531.99
mp-1178271
10.942462
7.95186
1.155392
other
Gd16As8O36
60
14
950.79
mp-10925
-3.558782
-4.28091
-4.279664
other
Pr8Se8O4
20
14
480.24
mp-8762
10.531341
7.435976
3.100584
other
Er8S8O4
20
14
372.33
mp-1246785
0.138235
2.682059
1.854972
other
Mn12Fe32N36
80
14
764.02
mp-768293
10.06008
7.002558
-2.968607
other
Lu8Se8O24
40
14
606.4
mp-10251
9.626326
8.752213
3.116615
other
Li4Dy4O8
16
14
206.44
mp-1047488
10.99164
7.924435
-4.205234
other
Sn6As8O32
46
14
689.65
mp-760798
9.524986
0.5993
-0.350739
other
Li8Cu4F20
32
14
361.79
mp-13753
13.145796
6.450996
-6.762385
other
Sm4P20O56
80
14
1,016.99
mp-17196
11.574335
7.577965
-4.270846
other
Ti4As8O28
40
14
546.3
mp-554142
10.352573
9.459344
-1.96081
other
Ge2Te4O12
18
14
273.13
mp-759535
8.414874
10.269145
-0.2098
other
Na12Cu20O16
48
14
762.84
mp-29613
-1.243513
2.375528
-2.201368
other
Cs4Eu8I20
32
14
1,346.85
mp-5248
-4.623873
-5.566778
0.41355
other
Na20Sn4As12
36
14
878.4
mp-779544
9.259876
8.675175
2.618928
other
Ba24Y12O42
78
14
1,618.93
mp-770694
8.169333
13.36834
-0.963653
other
Li12Cr4O14
30
14
264.99
mp-560126
11.135555
7.948059
-7.574541
other
Fe16P24O84
124
14
1,581.03
mp-1196854
7.538104
7.403443
-4.210957
other
Ba4B8O36
48
14
791.11
mp-728880
1.865822
2.373593
-3.470802
other
Ge8Br28N12
48
14
2,021.97
mp-1214786
-5.876737
-2.236657
-0.245022
other
As4Ru4S4
12
14
194.96
mp-1202156
7.786141
7.971764
-3.628067
other
Al4P4O24
32
14
440.31
mp-1201898
7.682375
7.462694
-4.325581
other
U8Cl4O44
56
14
1,093.76
mp-15432
-4.721478
-5.194612
0.278946
other
K16Ga16As24
56
14
1,468.93
mp-771237
7.636393
6.543437
-3.058325
other
Mn4I8O24
36
14
553.81
mp-1224643
1.572287
2.502057
-3.58408
other
Hg4I12N4
20
14
1,162.27
mp-1369701
8.847984
1.668454
1.234491
other
Mg4Sn4F20
28
14
426.38
mp-540256
9.010148
7.846803
-5.594032
other
Ni4P4O16
24
14
362.5
mp-1435359
11.186912
12.090694
-0.392311
other
Ca4V4O12
20
14
224.8
mp-1019576
2.125564
1.91181
1.498418
other
Ca16Si4N16
36
14
538.36
mp-1371936
8.301202
1.39159
0.858853
other
Zn4Bi4F20
28
14
488.08
mp-1221234
-2.510585
0.454642
2.507714
other
Pr50B28C52
130
14
2,186.3
mp-5824
6.299577
5.165056
-4.525254
other
Hg8N4O16
28
14
429.55
mp-761168
9.600959
1.932909
-0.040411
other
Li4V4F24
32
14
568.38
mp-755457
-4.88914
-0.900547
-5.324847
other
Li4Fe4S6
14
14
250.43
mp-560901
1.181581
2.464532
-4.79864
other
Pd16S16Cl16
48
14
1,158.85
mp-1204365
6.87077
6.127501
-3.698627
other
Ho4I4O36
44
14
628.65
mp-603935
7.842283
10.095501
-3.783434
other
Sr4Cr4O16
24
14
432.71
mp-30101
-3.860054
-5.606351
4.714656
other
Ba16Si12Br8
36
14
1,184.83
mp-557055
8.281597
2.568795
-1.018881
other
Cu2Cl2F20
24
14
315.65