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-675469
10.715345
9.254128
3.618204
other
Zr6Sc8O24
38
2
460.5
mp-542522
-0.851704
1.080292
-4.201363
other
Bi14Pd1Br16
31
2
1,151.37
mp-725566
7.78278
5.391702
-2.061538
other
Cr5P4O16
25
2
316.1
mp-1097805
12.522173
10.516332
0.030362
other
K4W4O10
18
2
266.8
mp-760161
5.822619
12.635936
-1.411787
other
Na2Ni5O10
17
2
189.05
mp-730523
8.175672
2.957675
-1.364689
other
Zn2O4F4
10
2
138
mp-642535
-3.47689
-1.363414
-5.154046
other
Cs8Sb28S46
82
2
2,478.51
mp-27343
2.805805
3.136783
-4.421592
other
Re4Cl8O9
21
2
465.08
mp-1246298
1.492071
1.758775
1.507388
other
Sr8Ru2N8
18
2
331.07
mp-1410367
7.762378
5.724764
-1.571631
other
Na14Al6O16
36
2
477.03
mp-18917
8.458042
10.924502
-0.134712
other
Na14Fe6O16
36
2
479.77
mp-1176887
5.589586
11.863421
-1.85717
other
Li7Fe3O10
20
2
183.42
mp-30127
13.796231
4.099449
-2.267976
other
Rb12B28O48
88
2
1,199.64
mp-1246068
1.448019
1.820037
1.455498
other
Ca8Ru2N8
18
2
278.52
mp-1314570
3.986923
18.9485
-1.87878
other
Li8Co4O12
24
2
205.11
mp-504284
14.101165
8.848825
-6.937995
other
V8P14O48
70
2
916.15
mp-555407
-2.958058
-2.376036
-5.891208
other
Nd12Si8S34
54
2
1,262.23
mp-1303136
5.624538
11.902065
-1.817305
other
Li8Fe4O12
24
2
202.35
mp-1283232
8.027665
5.161649
-6.290669
other
Fe4C8O24
36
2
453.68
mp-1196004
10.679558
10.072532
-2.383059
other
Re4Sb8O26
38
2
608.7
mp-1182657
8.102079
6.241878
-4.318481
other
Ca2B6O20
28
2
442.74
mp-1173439
10.635551
11.696363
3.275101
other
Pr4Nb12O36
52
2
754.88
mp-1220789
-5.494686
-2.3748
-1.512962
other
Nb2Si1Te4
7
2
210.67
mp-753788
10.257189
7.822882
-6.640041
other
Ni2P6O18
26
2
347.08
mp-1211105
8.713439
1.623653
0.289553
other
Li3As1F6
10
2
216.05
mp-530217
8.53972
1.460611
1.208897
other
Pr4Zr12F60
76
2
1,100.41
mp-756747
8.003276
17.364487
-0.127931
other
Li6Mn6O12
24
2
225.04
mp-1097020
-4.609324
-2.28635
-3.467902
other
Hf2Te6Se16
24
2
739.49
mp-1780696
11.548576
11.088464
-2.400742
other
Re1W2O8
11
2
161.73
mp-858693
7.822219
5.297014
-1.843351
other
Rb4Ta4O12
20
2
365.63
mp-1247451
2.238871
2.186438
1.689475
other
Mg6Ga6N10
22
2
285.27
mp-879789
7.294542
5.724435
-1.581915
other
Ba8Fe8O21
37
2
544.04
mp-1247323
0.367167
2.271912
2.066458
other
Re4W4N12
20
2
248.14
mp-555132
8.257834
1.643109
-0.703705
other
Bi2Xe2F18
22
2
346.9
mp-753981
10.721048
0.184566
1.244096
other
Li2Mn7F18
27
2
385.12
mp-1232078
-4.388162
-4.250072
-3.857609
other
Er8Mg4Se16
28
2
866.68
mp-1100906
10.42286
9.006665
-6.240902
other
V2P2O10
14
2
181.59
mp-1100522
7.204319
19.423393
-0.12173
other
Li9Mn7O16
32
2
296.86
mp-510351
12.615006
7.995503
-7.059389
other
Fe7P6O24
37
2
410.86
mp-1174322
6.981161
19.805183
-0.158892
other
Li8Mn6O14
28
2
260.72
mp-29984
10.469788
11.407151
-1.954104
other
Na16Mo4O20
40
2
492.11
mp-1247328
0.499677
2.667004
1.682017
other
Ni8Ru2N8
18
2
184.64
mp-29144
8.37904
1.883593
-0.642136
other
K2Te4F18
24
2
376.95
mp-1174287
7.07395
19.572945
-0.15611
other
Li8Mn6O14
28
2
257.76
mp-1246573
1.959314
2.109487
1.542326
other
Y6Pb6N10
22
2
445.92
mp-764935
6.408515
14.018396
-1.965877
other
Li2Co4O8
14
2
139.31
mp-755341
11.769129
1.385639
2.644264
other
Fe6O2F10
18
2
224.9
mp-1174374
4.229148
19.199617
-1.860301
other
Li7Co5O12
24
2
209.07
mp-1198315
8.336283
8.458713
-3.989104
other
Np4Tc8O46
58
2
1,099.67
mp-1196075
7.834329
0.109129
-4.529481
other
Si20H114C38
172
2
2,023.93
mp-760149
9.010434
2.839386
0.04871
other
W10O8F44
62
2
1,100.71
mp-1048537
12.869111
11.041531
1.679485
other
Ti4Zn4O8
16
2
221.08
mp-757528
12.18741
11.103935
-1.273245
other
Na11W13O39
63
2
814.07
mp-1245757
1.857492
1.893881
1.257692
other
Sr6In6N10
22
2
407.83
mp-768163
-5.200048
-3.78986
-2.873945
other
Li14Sb4S4
22
2
420.11
mp-530695
8.536117
1.452292
1.168728
other
Gd4Zr12F60
76
2
1,067.27
mp-1642624
7.032592
19.589787
-0.194392
other
Li14Mn10O24
48
2
444.1
mp-673118
13.861184
7.083917
-5.754639
other
Sn3P4O14
21
2
321.54
mp-729930
8.109174
5.588943
-1.377673
other
Li16Ti8O24
48
2
439.41
mp-850886
7.695701
6.544443
-1.56346
other
Fe8O10F6
24
2
270.77
mp-778071
8.454139
1.208547
1.879041
other
Ba6Y6F30
42
2
697.11
mp-1277476
6.563095
11.287189
1.096123
other
La4Co4O12
20
2
239.43
mp-785962
7.60703
5.313057
-2.110785
other
Rb8S8O28
44
2
787.98
mp-1182344
6.682446
6.072853
-3.744768
other
Ba2I2O10
14
2
284.35
mp-680286
5.724102
3.364514
-4.693121
other
Os10C38O38
86
2
1,425.74
mp-1285988
13.208434
11.724504
-0.01934
other
Li2V6O8
16
2
159.84
mp-1226586
-6.241644
-2.287497
-0.78754
other
Co4Ni4Te10
18
2
353.63
mp-1205910
8.623441
1.751644
0.481756
other
Mn1Cd3F6
10
2
504.95
mp-532491
8.54203
1.472786
0.944659
other
Eu4Zr12F60
76
2
1,075.98
mp-767873
11.864594
12.492643
-1.558276
other
V9Sb7O32
48
2
545.98
mp-1042994
7.657802
10.213341
-3.773476
other
Cr6Fe4O24
34
2
492
mp-28346
9.420863
7.039223
-3.46631
other
Sr4Se8O20
32
2
511.65
mp-752478
6.597763
10.627419
-1.19752
other
Na8Ni2O8
18
2
248.9
mp-758101
9.669614
0.480283
0.091275
other
Li4Cu3F10
17
2
217.92
mp-573340
0.752035
2.251396
-4.128428
other
Nb4Se34Cl24
62
2
1,877.17
mp-771975
7.055135
8.406417
-1.082824
other
Na6Tb3O9
18
2
251.14
mp-1029850
1.205284
2.540397
1.622668
other
K30Cr14N38
82
2
1,484.31
mp-758431
8.325242
14.423491
-1.452856
other
Rb3Mn16O32
51
2
599.81
mp-778978
12.30708
12.751796
2.385119
other
Ti34N12O48
94
2
1,112.84
mp-2236380
8.742849
14.709857
-0.81084
other
Mn4Zn2O8
14
2
174.57
mp-757485
10.514348
13.134369
-0.48587
other
Ti4Fe8O18
30
2
319.93
mp-28700
9.233165
0.88626
0.543676
other
Fe4Pb6F24
34
2
474.47
mp-1246657
1.402416
1.87901
1.391913
other
Sr8Mn2N8
18
2
361.47
mp-752835
9.732492
0.393317
0.292133
other
Li4Cu4F10
18
2
209.73
mp-1232103
-2.725428
-2.59821
-5.840367
other
Tb8Mg4S16
28
2
774.8
mp-29755
12.848068
6.575289
-0.830029
other
Ca4Si8O20
32
2
342.12
mp-780103
7.394855
8.088534
-1.757075
other
Fe8O10F6
24
2
269.98
mp-562466
6.409934
13.294149
-1.397811
other
Sr4Co4O12
20
2
259.8
mp-754468
7.05299
10.332329
-0.515235
other
Na4Cu4O8
16
2
209.95
mp-764995
7.249335
11.685287
1.898814
other
Sr12Mn6O23
41
2
570.51
mp-1196339
7.592878
6.610344
-4.691535
other
Zr2S4O26
32
2
594.2
mp-1542856
9.464076
0.824354
-0.398766
other
Zn2Co2F10
14
2
179.16
mp-1404938
7.520067
5.004757
-1.76309
other
Al2Co2O6
10
2
93.24
mp-1095577
-2.70965
0.704143
2.686535
other
Tm4B3C4
11
2
142.13
mp-1182308
7.574077
6.982608
-4.35331
other
Ca2B4O18
24
2
320.98
mp-1237338
8.066814
0.923839
1.202891
other
Rb3Bi1F6
10
2
347.55
mp-1247208
1.342592
2.239972
1.997626
other
Mn6Al6N10
22
2
236.73
mp-1405591
7.520007
5.056849
-1.801508
other
Mn2Al2O6
10
2
97.74
mp-29041
10.068623
10.109158
1.738376
other
La11V4O26
41
2
670.15
mp-1189524
-0.250867
0.508394
-3.016554
other
Tb6Ir1Br10
17
2
549.59