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-780860
9.874382
0.699329
-0.905404
other
Li4Co4O2F12
22
1
275.26
mp-2220282
10.74475
12.83851
0.300478
other
Mg1Ti8Ni8O24
41
1
424.39
mp-1234086
12.028993
11.562874
0.11321
other
Ca1Ti1Fe5O8
15
1
178.14
mp-801743
8.470709
4.055496
-1.075916
other
Li6V2O1F11
20
1
209.97
mp-780180
14.689042
5.364901
-2.606892
other
Li9Mn12B12O36
69
1
751.34
mp-806032
8.107271
4.823132
-1.482765
other
Li3V3O3F5
14
1
160.56
mp-758274
13.716858
5.61771
-2.96572
other
Li2Fe8B8O24
42
1
491.83
mp-773438
13.929782
7.116961
-6.445792
other
Li10Cu2P4O16
32
1
329.65
mp-867892
8.069228
17.166388
-0.150426
other
Li15Mn15Si1O32
63
1
595.72
mp-1174932
5.972573
18.62961
-1.086797
other
Li7Mn2Co3O12
24
1
192.11
mp-760683
12.771125
7.105612
-7.148746
other
Li4Cu1P6O18
29
1
343.4
mp-755384
10.043525
10.763061
3.273216
other
La12Ti12Cr4O48
76
1
959.89
mp-768430
8.464423
13.394789
-0.552567
other
Li24Ti7Cr5O36
72
1
644.58
mp-2232580
11.376557
11.068488
-2.84445
other
Mg1Hg4W2O8
15
1
302.11
mp-2230511
12.802727
-0.590347
0.38884
other
Mg1Mn6O7F5
19
1
231
mp-1235585
12.378638
-0.970981
0.947093
other
Li1Mn6O5F7
19
1
225.99
mp-1177416
11.82532
7.787879
-8.014416
other
Li10Mn8P16O56
90
1
1,053.42
mp-1235046
5.362383
11.815613
-2.224272
other
Li1Fe8O14F2
25
1
266.05
mp-775411
8.318048
13.530781
-1.258622
other
Li5Mn2Fe17O32
56
1
607.37
mp-1648324
6.345417
14.1198
-1.847554
other
Li8Co10Ni2O24
44
1
424.19
mp-1175076
3.678406
23.527218
-1.308099
other
Li7Mn2Co3O12
24
1
215.47
mp-753224
10.973293
7.875835
-2.156798
other
Li3Co2Ge2O8
15
1
186.96
mp-1176194
3.502072
23.256746
-1.466672
other
Li9Mn2Co5O16
32
1
291
mp-1238864
-5.095756
-0.275567
-5.555006
other
Ti4Cr4Cu4S16
28
1
560.08
mp-779276
13.799883
7.416532
-4.846275
other
Li2Cu10P4O16
32
1
360.55
mp-1228884
9.607215
6.18974
-3.849916
other
Cs2H6Se4O12
24
1
367.17
mp-27111
13.756543
7.196946
-5.897513
other
Li9Sb9P12O48
78
1
1,114.06
mp-1175779
4.003022
22.842253
-1.311681
other
Li9Mn2Co5O16
32
1
285.85
mp-1176885
12.001492
7.40417
-1.874008
other
Li7Fe6Si6O24
43
1
537
mp-669521
10.621678
10.040483
-1.397012
other
Nb12Te16Cl4O60
92
1
1,479.45
mp-2228335
13.225459
0.813067
1.708594
other
Mg1Fe6O6F6
19
1
228.33
mp-1174644
4.018724
22.956894
-1.293402
other
Li8Mn2Co4O14
28
1
249.18
mp-1224688
10.139863
3.831161
-4.448294
other
H15Se3N3O12
33
1
349.84
mp-759335
11.988232
8.852792
-7.923787
other
Li10V6P16O58
90
1
1,174.48
mp-759352
7.377086
11.483605
-0.555589
other
K8Li9Fe4O16
37
1
527.78
mp-755707
10.776226
12.333187
2.239049
other
K3Li1Ti7O16
27
1
367.15
mp-1176966
14.410764
8.131529
-5.636517
other
Li12P16W6O58
92
1
1,219.64
mp-1233915
11.828071
4.484617
-3.67475
other
Mg1Al4H12O12
29
1
247.2
mp-1175583
3.934841
22.909531
-1.323835
other
Li9Mn2Co5O16
32
1
286.71
mp-2228896
8.798374
15.01998
-1.128679
other
Mg1Mn6O10F2
19
1
212.36
mp-1176020
3.839936
23.0406
-1.391621
other
Li9Mn2Co5O16
32
1
285.68
mp-1227990
8.945487
5.384119
-4.122294
other
Ba1H3I1O6
11
1
127.87
mp-2230744
13.207247
0.862208
1.790056
other
Mg1Fe6O6F6
19
1
227.59
mp-771056
9.047977
14.706797
-0.255944
other
Li7Ti5Mn12O32
56
1
617.99
mp-1233729
6.379834
13.373139
-1.895107
other
Mg1Zn4Co6O16
27
1
295.32
mp-2230005
7.152997
13.717537
-1.784619
other
Mg1Mn2Co5O12
20
1
218.46
mp-2228150
12.310431
11.046107
-1.207528
other
Mg1Zn2W2O8
13
1
169.17
mp-783911
10.70201
3.006947
1.856211
other
Li12V24O12F60
108
1
1,314.3
mp-2230278
11.332187
12.575336
-2.574764
other
Mg1V2Cr4O12
19
1
238.32
mp-1076878
12.158928
10.120563
1.036535
other
La28Sm4V32O80
144
1
2,082.84
mp-1234326
7.877641
10.378492
0.718157
other
Ba6Mg1Ir6O18
31
1
457.63
mp-1239045
8.813497
5.056425
-4.296169
other
K2V2H8O14
26
1
345.98
mp-1179980
11.260174
11.316344
-2.148877
other
Nd1Cu1W2O8
12
1
171.45
mp-2217881
10.710937
2.501757
0.877891
other
Mg1V2O2F6
11
1
150.48
mp-1234766
12.723764
-0.944831
0.698003
other
Mg1Mn8O8F8
25
1
299.34
mp-849656
11.082869
7.53422
-2.403257
other
Li5Co4Si6O20
35
1
428.65
mp-1174834
5.221853
21.804306
-0.702913
other
Li6Mn3Co1O10
20
1
183.16
mp-684736
9.318694
2.122174
-3.312639
other
Ti1H12N3F7
23
1
277.43
mp-757416
10.128594
2.800787
1.77546
other
Li2V4O1F12
19
1
270.92
mp-1233420
11.372916
0.3049
1.600196
other
Ca1Mn6O4F8
19
1
257.85
mp-1176187
3.408191
23.397972
-1.498371
other
Li9Mn2Co5O16
32
1
288.76
mp-1234555
10.696346
2.23803
0.027726
other
Mg1V6O5F19
31
1
438.86
mp-1233717
11.547156
12.329536
-2.934624
other
K4Mg1V6O16
27
1
448.11
mp-1227241
7.876788
11.364669
1.562134
other
Ca8Al3Fe5O20
36
1
441.38
mp-2220305
12.876381
-0.293563
0.09361
other
Mg1Mn12O14F10
37
1
422.75
mp-2218284
12.641351
1.302742
2.047823
other
Mg1Fe4O4F4
13
1
157.79
mp-1233248
8.738714
8.261489
-1.338208
other
Ca1Al4Tl4O12
21
1
300.44
mp-2229039
13.571856
12.574108
-3.385431
other
Mg1V4O7F5
17
1
205.2
mp-1234506
6.83318
10.077143
-1.82367
other
K8Mg1Mn4O16
29
1
521.99
mp-2218008
13.981109
7.145003
-6.879874
other
Mg1Mn1P2O7
11
1
151.83
mp-1228773
8.771275
9.178815
2.065703
other
Ba6Y6Cu6O20
38
1
604.54
mp-1233255
14.403499
12.050378
-0.810531
other
Mg1V8O8F8
25
1
293.55
mp-779641
13.836133
7.431511
-4.869983
other
Li2Cu10P4O16
32
1
361.4
mp-754854
11.218135
3.242143
1.590768
other
Li3V4O3F9
19
1
216.55
mp-2230942
10.609875
14.240886
-0.941604
other
Mg1Mn6O8F4
19
1
226.87
mp-776415
10.757618
3.000599
1.854831
other
Li3V6O3F15
27
1
325.99
mp-2230714
12.730548
-0.564686
0.367059
other
Mg1Mn6O7F5
19
1
232.71
mp-2233253
11.035523
13.014478
-3.391887
other
Mg1V4Ag2O11
18
1
222.82
mp-1233763
9.364701
5.383033
-6.705097
other
Mg1Cr3S6O24
34
1
464.41
mp-780663
13.829628
5.432978
-2.843326
other
Li5Mn10B10O30
55
1
627.14
mp-765725
10.654509
11.592163
0.350449
other
Na3Li5Mn5O9
22
1
267.32
mp-851516
7.677547
4.987779
-1.827647
other
Li6Nb12Zn3O36
57
1
679.33
mp-776994
14.681891
5.384383
-2.60866
other
Li9Mn12B12O36
69
1
750.95
mp-1445676
12.45683
7.595001
-7.41258
other
Mg2Fe2P2O10
16
1
183.24
mp-2217103
14.573378
12.321846
-1.018826
other
Mg1V2O3F3
9
1
109.97
mp-707519
12.911737
7.11649
-0.470831
other
Mg16Si8H1O32
57
1
611.34
mp-759593
9.25193
14.181477
0.000247
other
Li5Mn3O5F3
16
1
156.12
mp-2230202
12.244152
11.401196
-1.591868
other
Mg1Cu3Mo4O12
20
1
236.95
mp-2220386
12.87991
-0.330404
0.120262
other
Mg1Mn12O14F10
37
1
424.18
mp-2231786
12.699219
-0.516267
0.384821
other
Mg1Mn6O7F5
19
1
237.45
mp-1234622
7.940193
10.437536
0.714641
other
Ba6Mg1Ir6O18
31
1
442.95
mp-1219551
9.413415
2.448088
-2.229988
other
Sb2H10O4F12
28
1
337.62
mp-2224156
12.74888
11.03868
1.016989
other
Mg1Ti2Fe2O6
11
1
119.67
mp-1233369
12.924543
12.26818
-0.427661
other
Mg1V12Zn6O24
43
1
482.23
mp-778856
14.709759
5.376954
-2.599163
other
Li6Mn8B8O24
46
1
503.65
mp-1236176
12.534391
13.406289
-1.705541
other
Li1V6O11F1
19
1
198.67
mp-1247640
7.007084
12.180496
1.381208
other
Sr4Ca12Mn16O44
76
1
931.89
mp-1222708
10.158821
4.699171
-5.520047
other
Li1H7S4O16
28
1
320.24
mp-764589
14.792031
5.772854
-2.603004
other
Li4Fe8B8O24
44
1
486.99
mp-776517
14.623732
5.230237
-2.64547
other
Li3Mn4B4O12
23
1
250.57