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-754733
8.719552
14.04375
-1.187544
other
Li4Ti2Cr3Co3O16
28
8
270.39
mp-754367
9.288425
13.321405
-0.538705
other
Li4Nb3Fe3Ni2O16
28
8
316.47
mp-774370
15.367405
5.626328
-2.280435
other
Li6Mn5Fe1B6O18
36
8
377.36
mp-1236627
12.228819
12.1355
2.31523
other
Sr2Li1Ti6N2O11
22
8
279.02
mp-1252036
11.936359
10.226674
1.165484
other
Sr4Y2Al2V4O14
26
8
365.22
mp-2242123
-0.383052
0.99912
-4.270011
other
Mg1Nb1Tl1Br4O1
8
8
235.84
mp-1247581
7.216746
12.161777
1.651105
other
Sr1Ca7Ti1Mn7O22
38
8
457.82
mp-2226919
11.836706
11.220908
-3.178393
other
Mg1Fe2Mo2Cl2O8
15
8
275.83
mp-757815
10.261042
12.855711
-0.698812
other
Li4Cr3Ni3W2O16
28
8
295.4
mp-774492
8.543216
14.165951
-0.955955
other
Li4Mn3Ni2Sn3O16
28
8
306.75
mp-771397
7.862842
14.016253
-1.083398
other
Li4Ti3Mn2Ni3O16
28
8
279.98
mp-867556
11.435975
12.441403
0.389786
other
Li4Nb3Fe3Sb2O16
28
8
346.73
mp-1644086
13.245641
7.306432
-6.72417
other
Na8V4B4P4O28
48
8
651.97
mp-2219104
-9.081966
2.975288
-4.663405
other
Mg1Te4Mo2W2S4
13
8
372.51
mp-1177356
12.304545
12.766809
-0.067289
other
Li4Nb3V3Fe2O16
28
8
319.15
mp-774787
10.195102
12.409245
-0.32074
other
Li4Mn3Sn2Sb3O16
28
8
347.4
mp-2233743
12.020713
9.864021
2.324527
other
Sm2Mg1Ti2Cl2O6
13
8
200.43
mp-771059
9.993931
12.829823
-0.103696
other
Li8Nb4Co6Sn6O32
56
8
653.45
mp-885334
10.728
14.064219
-1.024894
other
Li4Ti2Mn3V3O16
28
8
296.95
mp-1228573
7.742718
11.955943
-0.850864
other
Ba2Ca1Y1Co8O14
26
8
370.84
mp-770552
8.501625
13.733478
-1.125822
other
Li4Ti2Cr3Ni3O16
28
8
280.38
mp-1076062
5.358743
11.147878
-0.694293
other
Sr7Ca1Fe5Co3O24
40
8
468.33
mp-774791
10.026737
13.518016
-0.692085
other
Li4Mn3Cr3Te2O16
28
8
309.53
mp-1234470
-4.683243
-6.238295
1.074608
other
Rb2Ba8Ca1Sb6O2
19
8
763.4
mp-2219087
-8.655286
2.564252
-4.109165
other
Mg1Te4Mo4Se2S2
13
8
383.26
mp-1233097
12.551266
11.573423
2.178086
other
Sr2Mg1Ti6N2O11
22
8
286.49
mp-1235147
12.179471
12.15829
2.3329
other
Sr2Li1Ti6N2O11
22
8
273.12
mp-1177280
9.545071
13.966869
-0.040927
other
Li4Ti3Mn3Sn2O16
28
8
312.89
mp-1099887
8.270319
11.202537
1.906247
other
La7Sm1Mn5Fe3O24
40
8
480.69
mp-774858
10.997019
13.114133
-0.548031
other
Li4Mn3V2Sb3O16
28
8
324.1
mp-757929
12.250149
12.658409
-0.063209
other
Li4Ti2V3Sn3O16
28
8
317.11
mp-774333
12.050897
12.492932
-0.212231
other
Li4V3Sn3Sb2O16
28
8
343.06
mp-720201
7.487576
11.245837
1.883859
other
Ba4La6Mn5In5O30
50
8
678.84
mp-1099943
11.772014
11.021973
0.152966
other
K5Na3Nb4W4O24
40
8
519.95
mp-775298
9.650805
14.0324
-0.629348
other
Li4Mn2Cr3Sn3O16
28
8
311.48
mp-2232906
11.677553
9.970662
2.21538
other
Ba3Mg1Nb2Co1O9
16
8
239.74
mp-779210
7.339666
14.594107
-1.038183
other
Li4Mn3Fe2Cu3O16
28
8
277.89
mp-768668
12.687167
12.065853
0.054421
other
Li4Ti3V3W2O16
28
8
308.5
mp-2228148
8.159757
10.618185
-3.39507
other
K1Mg1Cr2Fe1O8
13
8
220.61
mp-1234224
12.46305
11.597562
2.271505
other
Sr2Mg1Ti6N2O11
22
8
301.91
mp-2219505
-9.068214
2.956829
-4.62487
other
Mg1Te4Mo2W2S4
13
8
374.47
mp-1234041
11.908864
10.888206
2.774725
other
Ba2Mg1Nb6N2O14
25
8
378.69
mp-765741
11.806276
12.730169
-0.35963
other
Li4Mn2V3Sb3O16
28
8
330.83
mp-2232754
11.722621
9.865979
2.109222
other
Ba3Mg1Nb2Co1O9
16
8
240.04
mp-758110
7.047669
13.70483
-1.827337
other
Li4V2Co3Ni3O16
28
8
274.7
mp-765636
6.393996
13.59868
-1.591159
other
Li4Mn2Fe3Ni3O16
28
8
273.77
mp-2223668
8.042111
10.787314
0.784606
other
Sr2Mg1Ni1Ru1O6
11
8
171.58
mp-735790
8.555843
14.729449
-1.072207
other
Li14Mn22Cr3Cu3O56
98
8
1,022.82
mp-774888
9.9738
13.052658
-0.844521
other
Li4Cr3Cu3W2O16
28
8
298.34
mp-774861
9.195836
13.752743
-0.798091
other
Li4Cr3Ni2Sn3O16
28
8
308.49
mp-1076107
5.60487
11.597563
-0.258086
other
Sr5Ca3Fe1Co7O24
40
8
457.11
mp-767657
11.063924
12.912866
0.722756
other
Li4Ti2Nb3Co3O16
28
8
311.75
mp-1275262
9.0838
11.620852
1.190703
other
Sr2La2V2Fe2O12
20
8
243.34
mp-695325
10.639989
10.486789
1.78826
other
Ti5Zn1Bi2Pb4O18
30
8
411.36
mp-756399
9.960635
13.792316
-0.369074
other
Li4Mn3Nb2Cr3O16
28
8
302.43
mp-1235213
12.167046
12.102819
2.329709
other
Sr2Li1Ti6N2O11
22
8
278.19
mp-776121
10.438203
13.762997
-1.073735
other
Li4V3Fe3Sn2O16
28
8
300.87
mp-2232007
12.40379
6.703328
-1.177959
other
Mg1Ti2Si2Ag4O10
19
8
310.54
mp-1222468
12.384496
8.847617
-5.721099
other
Li1Mo1P2W1O11
16
8
206.79
mp-1233407
10.482978
9.922112
1.646293
other
Sr4Ca1Mn2Ga2O10
19
8
310.07
mp-1177424
9.070646
14.171046
-1.392372
other
Li4Mn3V3Cu2O16
28
8
287.36
mp-2215844
9.146568
9.703578
1.478353
other
Ba1Y1Mg1Cu2O5
10
8
141.43
mp-1235395
11.51648
8.284917
2.730814
other
Li1Pr2Zn2P2O2
9
8
156.48
mp-849378
6.6059
13.807139
-1.651043
other
Li4Co3Ni3Sn2O16
28
8
282.98
mp-2239885
-9.615232
2.392346
-3.889544
other
Mg1Te4Mo2W1S2
10
8
318.94
mp-1235081
11.677659
8.372192
2.472576
other
Li1Tm1U2S3O2
9
8
153.57
mp-774877
9.722184
13.207364
-0.300234
other
Li4Ti2Fe3Sn3O16
28
8
316.91
mp-769517
8.459039
5.699735
-7.308525
other
Na4Mn4P4C4O28
44
8
596.04
mp-2226441
-6.794474
2.264769
-5.380663
other
Mg1Mo1W2Se4S2
10
8
345.96
mp-1234714
9.031358
11.22199
1.651518
other
Y2Mg1Mn2S2O5
12
8
170.81
mp-776096
9.381227
14.355501
-0.730356
other
Li4Mn3Cr3Sn2O16
28
8
298.52
mp-1520532
5.934564
8.558972
-0.125196
original
Sr1Ca1Dy1Bi1O6
10
8
150.5
mp-769581
8.177779
14.386913
-1.387914
other
Li4Mn3Cr2Co3O16
28
8
274.88
mp-849709
9.669709
13.46414
-1.230337
other
Li4Ti3V2Cu3O16
28
8
295.12
mp-1099698
6.780653
11.271407
1.211543
other
La4Sm4Co7Ag1O24
40
8
451.69
mp-2228499
13.816111
6.253601
-5.468204
other
Ba2Mg1Cu1P2O8
14
8
259.98
mp-756731
11.230859
12.395736
-0.028558
other
Li8Ti4Fe6Sb6O32
56
8
653.89
mp-676473
2.672607
3.039853
-4.606825
other
Te6H6S1Cl26O4
43
8
1,363.37
mp-2232635
11.844865
9.868957
2.065645
other
Ba3Mg1Mn1Nb2O9
16
8
242.96
mp-2216805
9.918675
9.340053
1.170662
other
Ba6Mg1Co2Sb4O18
31
8
486.14
mp-1263648
8.358292
0.760697
-4.417661
other
Al3H36C12N3F4
58
8
667.63
mp-2227582
11.933799
9.916384
2.368716
other
Tb2Mg1Ti2S2O5
12
8
205.24
mp-2242288
10.391553
9.111628
0.859236
other
Y1Mg1Sb1Pb2O6
11
8
196.45
mp-851095
8.646451
13.652896
-1.214818
other
Li4Mn3Cu3W2O16
28
8
302.19
mp-1235576
11.147635
9.557958
2.697359
other
K2Li1Nd4Nb2O12
21
8
319.88
mp-2217646
9.441736
8.843469
2.047364
other
Ba2Sm1Mg1Sb1O6
11
8
258.16
mp-1248168
11.992647
11.462434
0.182477
other
Y4Fe13Si2Sb2O28
49
8
643.05
mp-774860
9.435459
14.295333
-0.614168
other
Li4Mn3Cr2Sn3O16
28
8
311.84
mp-2232095
10.338559
11.268064
0.231785
other
Ba1Sr1Mg1Fe4O8
15
8
235.94
mp-774610
10.31816
12.64487
-0.891373
other
Li4V2Ni3Sb3O16
28
8
312.82
mp-1076602
5.482263
11.385385
-0.574898
other
Sr3Ca5Fe4Co4O24
40
8
452.59
mp-757051
8.674943
14.178568
-1.147394
other
Li4Mn3Cr3Ni2O16
28
8
281.34
mp-776497
11.82273
10.109218
2.526435
other
Li2La3Ti2Nb2O13
22
8
271.49
mp-708135
8.521461
3.308087
-4.960013
other
Y1H16C4N9O16
46
8
487.94
mp-754525
12.441569
12.569409
0.058718
other
Li8Ti6V6Te4O32
56
8
650.67
mp-2219139
10.724762
4.755764
-6.502119
other
Na1Mg1Fe1S2O8
13
8
160.76
mp-763275
8.431938
13.269168
-1.23808
other
Li4Co3Cu2Sb3O16
28
8
305.14
mp-867667
8.370303
14.360339
-1.250058
other
Li4Mn3Cr2Cu3O16
28
8
279.72
mp-2240375
9.444936
8.844832
2.323922
other
Ba2Ho1Mg1Sb1O6
11
8
215.15
mp-1233760
10.521878
9.809937
1.693762
other
Sr4Mg1Mn2Ga2O10
19
8
300.93