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-1249661
11.235015
7.747008
-2.402328
other
Li12Mn12Si12O48
84
33
851.73
mp-6639
11.129673
8.022838
-1.891076
other
Rb8Ge8Sb8O40
64
33
1,015.22
mp-1218081
10.037983
8.473834
2.792895
other
Sr4Sm8Be4O20
36
33
451.32
mp-757874
12.000724
7.016775
-1.095528
other
Li8Si8Bi8O32
56
33
735.41
mp-558085
11.417845
7.503137
-0.568859
other
K4Na4Ge4O12
24
33
367.68
mp-1224276
9.275511
1.719035
1.226122
other
K8V4O4F16
32
33
508.43
mp-605347
9.923602
5.034156
-4.224323
other
Hg4Te4H16O24
48
33
574.23
mp-764341
11.708004
7.658192
-1.840872
other
Li12Fe4Si4O20
40
33
427.8
mp-764957
12.743856
7.285861
-1.54699
other
Li8Co4Si4O16
32
33
339.51
mp-778669
10.629189
7.958517
-6.743499
other
Li8Cr4P4O24
40
33
419.35
mp-1173581
14.097608
5.518954
-6.995531
other
Na8Ti8P8O40
64
33
860.79
mp-1222933
10.203366
11.235733
3.193663
other
La4Ti4Nb4O24
36
33
467.95
mp-759053
11.539765
7.398192
-2.174072
other
Li4Fe4Si4O16
28
33
345.97
mp-1209775
10.27035
6.479869
-2.709906
other
Sr12Yb8B16O48
84
33
1,070.7
mp-558804
13.840525
4.392411
-2.259265
other
Cs4Ge4B12O28
48
33
692.33
mp-27115
14.148883
8.922617
-4.649047
other
Li8Mo8P8O40
64
33
925.67
mp-765579
14.836557
7.673052
-5.439873
other
Li12Fe4P4O20
40
33
437.57
mp-731921
8.216506
2.136663
-0.754976
other
Li4Be4N4F16
28
33
502.1
mp-1192933
12.830957
6.267804
-0.37056
other
Cs4Al4Si4O16
28
33
478.45
mp-757007
14.123532
7.318847
-6.553903
other
Li12Co4P4O20
40
33
425.96
mp-1227216
9.731603
8.648479
2.899523
other
Ca4La8Be4O20
36
33
466.79
mp-765591
14.75044
7.778026
-5.49029
other
Li4Fe4P4O16
28
33
377.95
mp-1200100
7.566074
5.22649
-5.297428
other
K4Al4C4O24
36
33
547.75
mp-1227167
9.977634
8.499187
2.797709
other
Ca4Nd8Be4O20
36
33
448.42
mp-9113
12.130219
6.535479
-4.879312
other
Cs4Be4As4O16
28
33
431.98
mp-14721
11.74083
7.076082
-2.443921
other
K8Si8Sb8O40
64
33
936.27
mp-765149
12.25034
7.431057
-7.287225
other
Li4Ni4P4O16
28
33
336.73
mp-16996
12.317283
7.195237
-0.82851
other
Li12Ga4Si4O20
40
33
419.58
mp-861534
12.085545
7.502884
-7.453242
other
Li4Ni4P4O16
28
33
333.66
mp-757209
12.184389
7.202952
-7.157703
other
Li4Cu4P4O16
28
33
347.34
mp-758499
11.582883
7.336012
-2.134395
other
Li4Fe4Si4O16
28
33
354.8
mp-1238445
9.930982
1.834195
-3.736682
other
Be8H64N16F32
120
33
965.09
mp-557352
8.200183
2.061079
-0.713477
other
Ca4P8Xe20F88
120
33
2,283.28
mp-726947
8.981392
7.521132
-4.864969
other
Be4P4N4O16
28
33
382.21
mp-27017
14.034943
7.079145
-5.468852
other
Li8Sn8P8O32
56
33
777.91
mp-26387
11.957856
7.473702
-7.44424
other
Li4Ni4P4O16
28
33
343.4
mp-728419
5.309012
2.951493
-3.484727
other
Cd4C28S12N16
60
33
1,445.02
mp-541459
13.307005
5.648752
-6.661388
other
K8Sn8P8O40
64
33
967.88
mp-857344
14.222397
7.444878
-6.861773
other
Li8Mn8P8O32
56
33
638.04
mp-757541
11.975084
7.01996
-1.169701
other
Li12Si12Bi12O48
84
33
1,127.75
mp-757833
13.750366
8.010673
-0.867188
other
Li8Fe4Si4O16
32
33
350.11
mp-542840
12.000299
6.903433
-0.996703
other
In8Si8Pb8O36
60
33
887.5
mp-768776
13.828632
4.57933
-2.28909
other
Li8Bi8B16O40
72
33
691.79
mp-13774
12.176225
6.572407
0.314493
other
Na12Nd12Si12O48
84
33
1,066.41
mp-1214563
9.214085
1.995795
1.489087
other
Ba8Na8V8F48
72
33
1,124.07
mp-1220097
13.666232
8.654776
-6.976357
other
Rb8V12P16O68
104
33
1,542.22
mp-1201175
9.033882
7.625311
-4.999605
other
Li4Be4As4O20
32
33
406.8
mp-18591
13.089945
5.499527
-6.243809
other
K4Zn4P4O16
28
33
402.4
mp-756723
8.951348
15.185455
-0.644723
other
Li4Mn8O12F4
28
33
297.21
mp-559752
12.957424
5.673014
-6.055684
other
Cs4Zn4P4O16
28
33
464.53
mp-774639
13.431694
7.566319
-0.763462
other
Li8Mn4Si4O16
32
33
356.9
mp-757890
12.131495
7.114065
-1.103503
other
Li12Si12Bi12O48
84
33
1,044.33
mp-505322
-5.930909
-3.267047
-2.075265
other
Cs4Ta4Cu8Te16
32
33
1,070.15
mp-1224117
10.127508
4.714678
-5.608934
other
Hg4H8S4O20
36
33
408.54
mp-646565
-1.051323
1.577748
-1.9266
other
Na4Ce16I28N8
56
33
1,910.7
mp-554274
8.726955
7.853731
-3.659828
other
Cs4Mo4I4O24
36
33
648.16
mp-13960
13.500971
4.66204
-1.428702
other
Sr12Er8B16O48
84
33
1,046.33
mp-14352
11.154136
7.990152
-1.930063
other
K8Ge8Sb8O40
64
33
988.35
mp-1222742
12.385999
7.037244
-0.597417
other
Li8Mg4Si4O16
32
33
348.59
mp-766350
12.016559
7.063885
-1.052821
other
Li4Si4Bi4O16
28
33
384.31
mp-760231
13.032555
5.937253
-7.240862
other
Li4Sn8P12O48
72
33
950.99
mp-1208295
11.879212
7.518983
-4.104219
other
Ti8Tl8As8O40
64
33
999.94
mp-554006
12.167909
6.505973
0.27628
other
Sr12Ca12Si12O48
84
33
1,129.85
mp-1357819
1.508018
2.414879
1.045134
other
Ba4Ca4Co8N16
32
33
820.99
mp-1516822
8.178954
6.884815
-3.290042
other
Sr1Zn1Se4O12
18
38
238.26
mp-1218451
7.494319
11.708052
2.138186
other
Sr3Pr1Mn2O8
14
38
190.4
mp-1520397
7.697617
8.637819
-1.05286
other
Na1Eu1Hf4O12
18
38
262.66
mp-1228068
9.982432
8.4274
2.801542
other
Ba6Dy2Al4O15
27
38
457.19
mp-2225895
12.689072
10.731627
1.364176
other
Mg1Nb1Cr1O4
7
38
87.66
mp-1220923
7.782718
10.873052
0.564755
other
Na3Tb3Ir3O12
21
38
253.89
mp-1218441
7.502137
11.653711
2.160309
other
Sr6La2Mn4O16
28
38
382.69
mp-2218520
12.083386
12.471673
-1.877478
other
Mg1V2Cr2O8
13
38
154.62
mp-1227939
7.883109
10.510166
1.959215
other
Ba1La3Ni2O8
14
38
195.52
mp-2241417
6.7574
10.049081
-2.195102
other
Na2Mg1Mn2O8
13
38
209.83
mp-1227740
-3.375598
-1.669833
-5.743815
other
Ca3Er2Sn3S12
20
38
448.93
mp-1048236
12.43592
10.523754
0.345782
other
Ba2Al1Mo3O8
14
38
206.49
mp-1220760
7.790403
10.904226
0.52086
other
Na3Y3Ir3O12
21
38
253.04
mp-1222951
10.448495
7.99545
2.563391
other
La1Gd3Br4O4
12
38
265.7
mp-2219066
11.574389
12.534657
-3.07671
other
Mg1Mn2V2O8
13
38
184.17
mp-1516638
8.173206
11.495084
-2.308418
other
Nd1Sm1Cr4O12
18
38
214.5
mp-752915
13.419016
8.7048
-1.585461
other
Li1V2Si2O8
13
38
136.99
mp-1518902
7.039959
8.658512
-2.050973
other
K1La1Sn4O12
18
38
274.11
mp-1247649
6.745839
12.189722
1.32445
other
Sr1Ca7Mn8O23
39
38
450.67
mp-1516824
7.202403
13.071126
-1.396781
other
Nd1Mn4Co1O12
18
38
205.65
mp-1522391
7.603707
9.28671
-1.128494
other
K1Nd1Ti4O12
18
38
236.9
mp-1517987
5.475464
9.976736
-2.487227
other
K1Nd1Fe4O12
18
38
225.07
mp-2231397
6.337434
9.579843
-1.517301
other
Mg1Ni2Bi4O12
19
38
282.47
mp-754750
11.811326
12.107204
2.238609
other
Ta8Cr4N4O20
36
38
419.61
mp-1521779
9.470085
8.232864
-3.141719
other
Ca1V1Ge4O12
18
38
201.61
mp-1520768
7.924654
9.737995
-0.7665
other
Li1Ce1Ti4O12
18
38
219.7
mp-1519790
7.628379
9.293169
-1.18741
other
K1Dy1Ti4O12
18
38
233.25
mp-1225921
-4.712802
-1.260042
-5.71601
other
Cu12Sb3As1S16
32
38
623.83
mp-557391
8.676665
3.614595
-7.15671
other
Na2Ca2C3O9
16
38
201.03
mp-1217964
-4.940389
0.282726
3.094772
other
Ta1B2Mo3C2
8
38
85.44
mp-1522087
10.067285
12.251394
-3.936687
other
K1Pr1V4O12
18
38
251.73
mp-1521719
7.600995
8.770718
-0.231577
other
Ba1Zr4Sn1O12
18
38
278.51
mp-1516411
8.289063
10.120412
0.058548
other
Nd1Ti4Sn1O12
18
38
224.17
mp-1218352
7.5093
11.701243
2.14407
other
Sr3Nd1Mn2O8
14
38
189.75
mp-1520155
7.709598
8.504308
-0.401905
other
Ba1Nd1Hf4O12
18
38
278.09
mp-2223703
7.362566
9.673495
-0.017646
other
Mg1Sc2Ag2O6
11
38
138.83