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-1177009
12.743854
8.704228
-7.927765
other
Li12V6P16O58
92
1
1,167.4
mp-759768
14.285604
5.674406
-2.81644
other
Li3Fe8B8O24
43
1
486.33
mp-1147698
-2.387253
-0.541562
-5.657598
other
Li10Zn1P4S16
31
1
627.36
mp-780480
10.473297
2.787508
1.920755
other
Li11V6O5F19
41
1
448.25
mp-1175653
4.092929
22.619186
-1.325221
other
Li9Mn2Co5O16
32
1
282.69
mp-1273419
12.879426
12.514894
-0.029613
other
Li6Ti2V4O12
24
1
227.05
mp-504236
9.316488
7.961755
-5.796179
other
Li9Ni9P12O48
78
1
930.38
mp-2231483
6.458639
12.308937
-1.316568
other
Na3Mg1Ni5O10
19
1
241.98
mp-777694
12.511743
13.262487
-0.446417
other
Li4Ti3V5O16
28
1
295.04
mp-1177211
11.361504
8.935608
-7.752028
other
Li8V6P16O58
88
1
1,174.43
mp-760280
14.779253
5.775278
-2.602877
other
Li4Fe8B8O24
44
1
486.44
mp-1174610
3.959628
23.082468
-1.28267
other
Li8Mn2Co4O14
28
1
250.52
mp-2230029
11.019606
8.857182
2.520256
other
Lu6Mg1W1O12
20
1
258.16
mp-2228839
8.808473
15.095663
-1.109891
other
Mg1Mn6O10F2
19
1
208.47
mp-781616
13.942231
5.465536
-2.831158
other
Li4Mn8B8O24
44
1
495.45
mp-662522
12.714283
6.190125
-0.732199
other
Na4Zn2Si4O12
22
1
294.83
mp-754315
11.057034
13.403788
-2.413561
other
Li3V4Sn1O12
20
1
207.69
mp-1046939
12.254833
10.579249
-0.68462
other
Ba2Tl2W4O12
20
1
342.16
mp-1233450
10.395689
8.635694
2.982725
other
Y1Th9Mg1O20
31
1
450.78
mp-2229368
13.565268
12.56378
-3.359419
other
Mg1V4O7F5
17
1
209.36
mp-2229293
11.978545
11.555793
2.024982
other
Mg1Nb4V1O12
18
1
231.34
mp-759905
11.99195
8.867137
-7.90566
other
Li10V6P16O58
90
1
1,168.84
mp-1406703
7.643819
5.770057
-1.852352
other
Li8Co2O6F2
18
1
186.59
mp-1175246
6.346522
20.327236
-0.447583
other
Li7Mn4Co1O12
24
1
217.64
mp-1239273
-5.436617
-0.142381
-5.668913
other
Nb2Cr6Cu4S16
28
1
520.48
mp-1224465
10.792301
10.792353
-3.871871
other
K3Rb5Mo12O40
60
1
1,053.06
mp-1216064
11.236673
10.987075
-3.808959
other
Zn3Cu3Mo6O24
36
1
544.17
mp-2225985
10.367554
2.4345
2.057915
other
Mg1Fe2O2F2
7
1
85.13
mp-759785
13.744794
11.874301
-0.157944
other
Li8V8O8F16
40
1
497.68
mp-778354
10.508842
2.789212
1.953955
other
Li11V6O5F19
41
1
455.39
mp-2228361
10.379356
10.742354
-0.51434
other
Mg1Mn2Sb4O12
19
1
257.32
mp-1304822
11.289048
12.208837
-0.058827
other
Li10Fe6Sb4O20
40
1
425.69
mp-1246990
-4.801152
-0.332919
-5.47479
other
Hf4Cr4Ag4S16
28
1
579.92
mp-2218347
12.857896
1.05172
1.814878
other
Mg1Fe4O4F4
13
1
141.24
mp-2220488
9.415268
0.674077
-0.136648
other
Mg1Cu6O1F11
19
1
239.29
mp-1176231
3.443891
23.251024
-1.466944
other
Li9Mn2Co5O16
32
1
293.73
mp-2224195
-5.790526
1.799041
-4.886063
other
Mg1Mo1W1S4
7
1
196.55
mp-1229257
8.197115
7.976141
-4.354086
other
As1P3Pb2O16
22
1
325.86
mp-1235358
1.605827
1.772528
2.962973
other
Li1Hf8N8O4
21
1
259.22
mp-1177190
11.383383
8.933564
-7.752236
other
Li8V6P16O58
88
1
1,180.76
mp-775943
10.754736
3.019273
1.854798
other
Li3V6O3F15
27
1
326.44
mp-849708
14.258343
5.677134
-2.828421
other
Li3Fe8B8O24
43
1
484.16
mp-1277588
6.506529
14.760242
-1.4966
other
Li10Co6Ni4O20
40
1
357.36
mp-2231366
12.846174
-0.632793
0.369491
other
Mg1Mn6O7F5
19
1
225.63
mp-1225360
9.203905
10.869124
-0.240305
other
Fe4Co1Bi5O15
25
1
353.82
mp-1235319
9.892156
11.331178
1.088692
other
Li1Sc4Fe4O12
21
1
224.38
mp-778120
12.280322
7.139087
-1.922441
other
Li5Mn4Si6O20
35
1
424.31
mp-1296460
11.992733
7.444186
-1.621047
other
Li8Si4Ni4O16
32
1
351.24
mp-801980
8.27917
3.71342
-0.968373
other
Li3Ni5O1F11
20
1
212.44
mp-780774
8.139934
4.130038
-7.044567
other
Li18Mn4C16O48
86
1
906.62
mp-1174731
3.520707
23.307518
-1.41291
other
Li8Mn2Co4O14
28
1
254.82
mp-2225008
11.503866
11.239142
-2.126105
other
Mg1V2Pb3O8
14
1
251.35
mp-1320203
6.529544
14.185906
-1.48925
other
Li10Co4Ni6O20
40
1
345.88
mp-1237047
10.146353
3.696876
-4.337697
other
Mg3H6Se1O3
13
1
202.38
mp-768398
8.31155
13.448286
-0.843863
other
Li24Ti5Cr7O36
72
1
643.2
mp-2232399
7.671989
12.163635
-1.063449
other
Mg1Cd2Ni4O8
15
1
170.3
mp-753364
8.755253
14.457685
-0.079306
other
Li8Mn4O8F4
24
1
222.53
mp-1235219
10.575819
9.573837
-0.310232
other
Li1Zn1Sb4O8
14
1
223.33
mp-1235326
11.571425
12.042771
0.057985
other
Li1Mn9Cd1O10
21
1
250.11
mp-1212544
11.169524
5.525025
-3.841274
other
Na3V3H6O7
19
1
877.38
mp-774910
9.298048
10.452126
-1.953927
other
Li1Sb1Te3O12
17
1
190.88
mp-1176893
14.889508
8.46315
-5.94117
other
Li7V4P6O24
41
1
482.28
mp-1176003
3.968706
22.900595
-1.318917
other
Li9Mn2Co5O16
32
1
288.54
mp-1222870
-6.163037
1.532654
-4.770271
other
La1Mo6Se4S4
15
1
304.04
mp-1174052
4.317529
22.809216
-1.102993
other
Li6Mn2Co2O10
20
1
177.61
mp-1174849
5.854032
20.78063
-0.610992
other
Li6Mn3Co1O10
20
1
179.65
mp-1147725
-2.40758
-0.493764
-5.605871
other
Li12Zn3P6S24
45
1
941.13
mp-1217217
10.343738
9.842041
0.319425
other
Ti3Bi6W1O18
28
1
377.24
mp-26247
13.893141
7.111286
-6.453343
other
Li10Cu2P4O16
32
1
330.49
mp-759755
12.769948
8.687632
-7.936108
other
Li12V6P16O58
92
1
1,153.96
mp-761047
12.13257
12.551348
0.046926
other
Li10V3Cr5O16
34
1
307.2
mp-1099795
6.917637
9.868486
0.006453
other
Ba28Sr4Cu32O80
144
1
2,187.14
mp-768431
8.277045
13.439542
-0.861615
other
Li24Ti5Cr7O36
72
1
641.93
mp-764796
14.270027
5.680682
-2.817508
other
Li3Fe8B8O24
43
1
484.56
mp-1180280
5.690679
3.257114
-3.794065
other
Mo3C8S13N2
26
1
628.33
mp-1233224
8.776752
15.077952
-1.312358
other
Mg1Mn8O13F3
25
1
272.39
mp-850007
11.971531
9.336723
-7.539938
other
Li7V16P24O96
143
1
1,738.79
mp-2230074
13.21836
0.83374
1.735327
other
Mg1Fe6O6F6
19
1
229.09
mp-760770
11.376931
8.943892
-7.750463
other
Li8V6P16O58
88
1
1,187.45
mp-1273123
11.197333
12.815417
0.401306
other
Li8Ti4Fe4O16
32
1
310.54
mp-752780
9.734344
12.001525
0.13997
other
Li8Fe1Co3O8
20
1
207.07
mp-759129
15.231881
5.880886
-2.408455
other
Li5Fe8B8O24
45
1
485.96
mp-1343228
7.805892
6.159842
-2.164608
other
Li9Mn2Co5O16
32
1
282.54
mp-1247411
-4.830866
-0.327225
-5.439621
other
Zr4Cr4Ag4S16
28
1
587.19
mp-2229250
13.615042
12.508613
-3.367229
other
Mg1V4O7F5
17
1
211.94
mp-778244
11.140541
3.200207
1.675499
other
Li6V8O6F18
38
1
437.97
mp-731799
7.660584
4.833812
-5.41912
other
Mg12C6Cl6O36
60
1
1,133.2
mp-2220516
9.443509
0.689159
-0.275188
other
Mg1Cu6O1F11
19
1
231.56
mp-1235140
10.405627
0.682316
-0.048193
other
Li1Co6O2F10
19
1
220.7
mp-2230529
8.653723
10.391161
0.007578
other
Na8Mg1Fe2O8
19
1
273.05
mp-1373887
7.695169
5.956248
-2.007579
other
Li9Mn2Co5O16
32
1
285.17
mp-849650
12.372451
7.595301
-7.949803
other
Li12Mn8P16O56
92
1
1,076.39
mp-1177186
11.992266
8.859673
-7.916185
other
Li10V6P16O58
90
1
1,165.84
mp-1227806
9.396723
7.780565
-1.644376
other
Ca3Al4Si1O12
20
1
254.19
mp-893087
15.031507
6.110568
-2.415218
other
Li10Mn12B12O36
70
1
751.4
mp-757797
14.539447
7.846538
-4.96853
other
Li4Ti4P8O28
44
1
503.55
mp-1380156
8.201369
4.119021
-4.53478
other
Cd2H16N4O20
42
1
417.56
mp-1226859
-6.126424
-3.228289
-2.251971
other
In4Cu3Ag1Te8
16
1
511.82
mp-771853
9.263695
13.704592
-1.576448
other
Mn3Nb2Cr3O16
24
1
282.9
mp-776437
11.022965
10.663977
3.452308
other
La4Ta8N4O20
36
1
483.92