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-758205
11.691998
7.77178
-7.689722
other
Li2Fe3P9O28
42
2
496.75
mp-759308
10.488386
8.264743
-7.292327
other
Li4Mn4P6O24
38
2
453.11
mp-1397105
0.561279
1.25114
-3.017178
other
Rb2Nb6Cu2Cl18
28
2
681.81
mp-1222860
14.208945
5.418731
-2.455147
other
Li28Mn4B12O36
80
2
802.72
mp-1105584
10.943393
11.554091
-2.912227
other
V2Zn4Bi2O12
20
2
271.67
mp-24399
10.483192
3.955248
-4.445477
other
Mg2H20S2O18
42
2
393.3
mp-556481
9.107838
6.770292
-3.671269
other
Sr2U2Se4O16
24
2
412.8
mp-1211413
14.110356
8.471349
-5.484569
other
K1Mo2P4O14
21
2
295.31
mp-560411
-3.346306
-1.127834
-5.151821
other
Cd1Sb6S8I4
19
2
592.44
mp-1176657
7.337888
14.870089
-1.468285
other
Li2Mn2Co2O8
14
2
141.87
mp-1175453
4.059204
22.673534
-1.321086
other
Li9Mn2Co5O16
32
2
283.74
mp-771651
8.352151
14.88233
-0.987006
other
Li8Mn13Fe3O32
56
2
595.29
mp-697120
9.747168
2.052709
-3.31016
other
B2H6N2F8
18
2
164.82
mp-2230426
10.719904
14.179761
-1.120967
other
Mg1Mn6O8F4
19
2
220.01
mp-759693
10.398977
12.327632
0.214098
other
Li6Mn2O4F2
14
2
153.87
mp-2228461
11.104992
12.303325
-3.170117
other
Mg1V2Cu3O8
14
2
195.46
mp-555933
12.92458
5.870549
-6.215238
other
Na4P4Pb2O14
24
2
331.96
mp-849733
14.567201
8.370602
-6.550665
other
Li4V4P8O28
44
2
541.91
mp-1200155
10.302284
4.175663
-4.81683
other
Cu5H14S2O18
39
2
375.41
mp-1174149
7.21207
18.745176
-0.367894
other
Li4Mn3Co1O8
16
2
152.15
mp-1310605
12.465881
13.192716
-0.666824
other
Li4Ti4V6O20
34
2
387.51
mp-768746
10.893847
13.520561
-0.045769
other
Li8Cr6Ga2O16
32
2
295.06
mp-1216516
10.315957
12.275509
-3.87937
other
V6Zn4Ga2O22
34
2
430.14
mp-768872
10.89669
13.527415
-0.04572
other
Li8Cr6Ga2O16
32
2
295.05
mp-2219545
6.792396
13.815496
-1.939694
other
Mg1Mn1Co3O8
13
2
141.65
mp-1175461
4.126908
22.612265
-1.299865
other
Li9Mn2Co5O16
32
2
286.37
mp-1204386
9.554968
3.590396
-5.085327
other
Co3H24C6O24
57
2
547.51
mp-1193380
7.033952
4.789915
-4.133192
other
K8Sn2S8O8
26
2
693.2
mp-554539
12.54572
6.094663
-0.584974
other
Ca12Si6H4O26
48
2
615.04
mp-849395
11.467241
7.755059
-7.781096
other
Li6Fe4P6O24
40
2
470.17
mp-1211004
10.881919
11.342776
-2.194225
other
Li2Sm2W4O16
24
2
318.89
mp-729935
4.660032
2.921282
-3.813373
other
C4N2Cl2O2
10
2
209.12
mp-780327
13.421576
5.469602
-2.957149
other
Li2Mn6B6O18
32
2
370.69
mp-24516
12.353329
7.361854
-6.411869
other
Co7P6H4O24
41
2
434.14
mp-723120
8.503881
2.997427
-5.019508
other
Ba2H12C8O14
36
2
394.19
mp-1348422
7.878449
5.146599
-1.802344
other
Sr2Sn2P4O16
24
2
334.08
mp-654202
4.217645
2.246975
-3.179404
other
Tl8Fe2C12N12
34
2
739.94
mp-649107
8.27977
2.276895
-1.067368
other
Re2Te14O14F64
94
2
1,546.33
mp-558889
11.2018
7.9165
-7.404322
other
Fe5Cu2P6O24
37
2
423.12
mp-8294
10.054955
9.686122
0.389506
other
Cs4Li4Ti2O8
18
2
307.12
mp-1047061
12.124994
10.962949
-1.745061
other
Y1Te1W2O8
12
2
176.83
mp-1202429
8.736289
3.062055
-5.183645
other
Fe2H14C8O16
40
2
386.24
mp-650532
8.993127
8.530914
0.171367
other
Cs4K4Cd6O10
24
2
518.46
mp-2228481
8.699091
14.737148
-0.935867
other
Mg1Mn3Cu2O8
14
2
153.48
mp-19067
10.279683
12.158184
-3.844152
other
Mg3V6Fe4O24
37
2
489.41
mp-768690
10.903372
13.512549
-0.042927
other
Li8Cr6Ga2O16
32
2
295.07
mp-1042009
14.804268
8.084979
-5.086639
other
Ca4V4P8O28
44
2
559.13
mp-752873
9.901511
12.295096
0.160476
other
Li32Fe4O16F8
60
2
613.96
mp-768470
12.288608
7.959776
-8.215271
other
Li3Mn6P6O24
39
2
448.05
mp-765605
14.807238
7.833419
-5.523838
other
Li4Fe4P4O16
28
2
353.48
mp-753077
9.574582
13.789548
-1.157159
other
Li3V2Fe3O10
18
2
190.71
mp-558321
12.74777
8.532247
-5.951913
other
Cs2Mo8P14O56
80
2
1,269.39
mp-769575
12.898601
7.573882
-7.301161
other
Li6Co5P8O28
47
2
514.84
mp-695955
10.787221
3.22009
-4.624452
other
P6H22N8O18
54
2
535.7
mp-1306185
6.771537
14.226099
-1.819416
other
Li4Mn2Co6O16
28
2
284.28
mp-1651525
12.098627
7.452331
-1.727219
other
Li4Si8Ni10O28
50
2
551.79
mp-760000
12.718237
12.036044
1.346474
other
Li12Ti15V3O36
66
2
718.46
mp-1191386
11.507811
7.479181
-4.158556
other
Ba4Co4As8O28
44
2
665.36
mp-1193713
7.592046
7.704171
-4.125726
other
K4Te2S2O20
28
2
494.63
mp-1179193
4.740305
2.835003
-3.621617
other
Tl2C8S8N2
20
2
607.78
mp-24635
9.971516
5.225853
-4.095555
other
Re2Ni1H8O12
23
2
283.42
mp-724946
7.711722
5.580527
-1.86008
other
Li4Lu2Si2O10
18
2
217.62
mp-1198569
10.672546
5.905995
-2.993244
other
Na2Nd2B12O26
42
2
494.35
mp-1175535
4.130643
22.605619
-1.304683
other
Li9Mn2Co5O16
32
2
282.58
mp-757207
10.292018
4.507132
-5.760038
other
Y2H10S6O26
44
2
513.37
mp-778031
14.963429
5.98061
-2.083757
other
Li12V4B8O24
48
2
520.09
mp-1196028
7.558157
5.846994
-5.004616
other
Lu8B8N8O52
76
2
1,067.47
mp-1290870
11.629151
7.711989
-7.951858
other
Li6Mn2P4O16
28
2
283.73
mp-721650
9.885428
3.29918
-3.739609
other
Ca2H28I20O14
64
2
1,403.51
mp-893545
7.29551
4.749786
-1.511358
other
Li4Fe2Ni3O10
19
2
178.31
mp-746820
8.55735
5.313482
-4.368186
other
Ni1H6S2O12
21
2
325.66
mp-1191319
9.295524
7.631505
-5.243525
other
Na2Al1P4O14
21
2
280.21
mp-755397
9.674584
13.973792
-0.191295
other
Li10Mn6Sn4O20
40
2
419.96
mp-1233320
7.990199
10.393438
0.698682
other
Ba6Mg1Ir6O18
31
2
442.62
mp-849145
9.494024
13.479074
-0.997183
other
Li3V1Fe3O8
15
2
151.04
mp-720406
12.523361
4.706452
-3.115279
other
Na4B10H10O24
48
2
493.27
mp-1180955
8.257912
6.899484
-5.007492
other
K8P6N2O26
42
2
766.95
mp-774722
8.690484
9.567245
2.339092
other
Li1La20Cu9O40
70
2
960.3
mp-1369672
7.593476
5.224657
-1.91979
other
Ba4Cu8P8O32
52
2
751.73
mp-561160
-2.17512
-0.174116
-5.010197
other
Nb2P8S20Cl10
40
2
1,243.85
mp-1193494
13.786247
7.480875
-6.597551
other
Mn4Ag4P4O16
28
2
361.57
mp-1105573
-5.819976
-3.88232
-1.706737
other
Ba4Gd2Ga2Te10
18
2
664.8
mp-1208658
-2.141681
-0.132434
-5.001993
other
Ta2P8S20Cl10
40
2
1,180.97
mp-698164
13.424117
4.369133
-2.646463
other
Rb4B20H12O38
74
2
836.37
mp-752902
9.815578
7.893738
-6.290708
other
Li2Ni2P4O14
22
2
269.4
mp-1662022
11.695251
11.512939
2.200488
other
Ta8Zn8Cr4O32
52
2
625.17
mp-558892
11.132229
11.68831
-2.838904
other
Mn2V2Bi2O10
16
2
237.75
mp-698267
8.335297
4.513009
-5.46067
other
Co6H6C6O18
36
2
490.06
mp-2233216
12.623295
10.926056
0.587727
other
Mg1Ti2Fe4O8
15
2
169.37
mp-757885
14.126913
7.240011
-5.284372
other
Li4Sn4P4O16
28
2
370.68
mp-1376100
14.0272
7.571053
-6.140614
other
Zn4Fe4P8O28
44
2
539.37
mp-32395
12.36504
7.459193
-7.245794
other
Li4Ni6P8O28
46
2
500.92
mp-1175777
3.987395
22.926622
-1.32231
other
Li9Mn2Co5O16
32
2
286.83
mp-770903
13.003592
5.675288
-2.954185
other
Li12Mn4B8O24
48
2
491.59
mp-1372639
7.708271
6.011353
-1.992781
other
Li6Mn2Co2O10
20
2
178.56
mp-1228833
6.955949
1.354028
-3.881647
other
B6H12C6N6
30
2
439.92
mp-1308812
6.081329
11.290934
0.43471
other
Sr2La4Co6O18
30
2
360.55
mp-734561
12.105969
5.208832
-5.477698
other
Rb6P6H8O24
44
2
662.91
mp-759827
9.590483
12.406234
0.048953
other
Li32Co4O16F8
60
2
554.72
mp-705494
6.532704
0.459232
-3.533523
other
K4B20H26O4
54
2
585.87