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-1238873
-5.064731
-0.086978
-5.626005
other
Ti4Cr4Ag4S16
28
31
504.03
mp-1210475
12.213905
6.724466
-1.359111
other
Na8Co4Si4O16
32
31
415.65
mp-559240
13.437979
7.584062
-0.786246
other
Li8Mn4Si4O16
32
31
350.39
mp-1182785
12.651482
6.052525
-0.463492
other
K12Ho4Si12O36
64
31
1,219.38
mp-1221056
9.954256
11.160482
3.209847
original
Na2Dy2Ti4O12
20
31
225.58
mp-1020621
13.842471
4.247451
-2.268565
other
Rb4Be8B12O28
52
31
617.17
mp-1049207
8.733129
8.634701
0.185313
other
Ho2Mg2Bi4O12
20
31
291.35
mp-554698
11.45767
11.043512
-3.61295
other
K20Mn2Mo14O54
90
31
1,652.29
mp-1246312
-4.993331
-0.472594
-5.579492
other
Hf4Cr4Cu4S16
28
31
511.12
mp-1227152
7.282626
12.216491
1.711945
other
Ca2Tm2Mn4O12
20
31
222.49
mp-755524
8.857335
12.48086
-0.683535
other
Li4Al2Fe2O8
16
31
175.29
mp-1044733
5.924538
11.391828
-0.249531
other
Ca2Pr2Ni4O12
20
31
223.62
mp-1278779
7.489561
11.012578
1.490154
other
Sr8Nb4Co4O24
40
31
514.87
mp-1220785
9.789453
11.076944
3.28346
other
Na2La2Ti4O12
20
31
235.98
mp-1044508
10.616586
9.287797
1.096788
other
Ca2Pr2Sn4O12
20
31
279.13
mp-1092268
2.764257
2.238292
1.723789
other
Ga2Si2C2N2
8
31
89.79
mp-1044410
6.78643
9.468824
-1.368821
other
Pr2Mg2Ag4O12
20
31
254.7
mp-1199160
13.532244
4.617027
-2.537668
other
Co12B44H4O80
140
31
1,125.69
mp-1044536
5.926432
11.018771
-0.296238
other
Pr2Mg2Fe4O12
20
31
224.49
mp-1221423
13.255139
6.884094
-0.866822
other
Na12Mn6Si12O36
66
31
814.16
mp-1247010
-4.877243
-0.474303
-5.639354
other
Zr4Cr4Ag4S16
28
31
542.58
mp-13982
-4.59087
-1.35549
-5.791965
other
Cd2Cu4Ge2S8
16
31
316.67
mp-1105735
7.579889
7.209496
-4.381663
other
Mn2As2N2O10
16
31
257.22
mp-1204543
10.106315
10.198393
3.164118
other
Ba12Nb6H2O28
48
31
837.46
mp-1044777
5.896719
11.143077
-0.358425
other
Pr2Zn2Fe4O12
20
31
225.75
mp-1221068
9.994041
11.190495
3.198817
other
Na2Er2Ti4O12
20
31
223.41
mp-1210824
-5.194818
-2.773297
-4.152096
other
Mn2Cu4Si2Se8
16
31
353.86
mp-1227111
11.820883
7.598887
1.362757
other
Ca2La2Al6O14
24
35
320.85
mp-1217991
-5.820367
-2.973362
-2.524873
other
Ta1Cu3Te2Se2
8
35
202.94
mp-1217786
11.266994
7.667649
1.123476
other
Sr2Y2Ga6O14
24
35
340.5
mp-1217789
11.250479
7.672028
1.064421
other
Sr2Sm2Ga6O14
24
35
345.3
mp-1218220
11.77765
7.619192
1.462801
other
Sr2La2Al6O14
24
35
334.72
mp-1221071
-7.644449
0.891191
5.030375
other
Nd8Cr6Fe50B4
68
35
932.41
mp-1221065
-7.742607
0.651875
5.400362
other
Nd8Sc6Fe50B4
68
35
970.55
mp-1218172
11.868487
7.552238
1.422562
other
Sr2Nd2Al6O14
24
35
328.61
mp-1218197
11.216692
7.648633
0.975388
other
Sr2La2Ga6O14
24
35
355.88
mp-1220903
10.670732
11.012847
2.242065
other
Na1Ti2Bi1O6
10
35
126.9
mp-1216363
-4.713947
-1.542424
-5.127941
other
V1Cu3Se2S2
8
35
167.32
mp-1220952
10.590938
11.635214
3.289659
other
Na2Sr4Nb10O30
46
35
649.86
mp-1227901
11.088052
7.68115
1.000086
other
Ba2La2Ga6O14
24
35
372.77
mp-1101095
8.898573
0.666286
-0.053804
other
Cs2Mn1O1F5
9
35
190.2
mp-1218014
11.844127
7.571792
1.428728
other
Sr2Pr2Al6O14
24
35
330.59
mp-1225353
-8.799692
0.046652
3.834626
other
Gd2Co4Ni4B2
12
35
149.77
mp-1228527
10.340767
11.392523
3.298629
other
Ba6Nb9Co1O30
46
35
664.88
mp-1225633
-7.39353
-1.854559
2.523015
other
Er1Mn2Fe4Sn6
13
35
230.43
mp-1227153
11.263957
7.705512
1.007873
other
Ca2La2Ga6O14
24
35
342.45
mp-1215414
10.677997
10.910032
2.302303
other
Zr1Ti4Pb5O15
25
35
348.51
mp-1227208
11.299488
7.715249
1.06234
other
Ca2Sm2Ga6O14
24
35
330.85
mp-1228362
9.643921
10.79244
3.310748
other
Ba2Sr1Ti3O9
15
35
195.57
mp-1220671
-7.648863
0.914361
5.033805
other
Nd8V6Fe50B4
68
35
955.18
mp-1225817
-7.935176
0.553351
4.731735
other
Dy2Fe4Co4B2
12
35
151.68
mp-1222555
-7.947783
0.539778
4.665752
other
Lu2Fe4Co4B2
12
35
148.71
mp-1218050
11.229856
7.691012
1.040737
other
Sr2Pr2Ga6O14
24
35
351.73
mp-1227104
12.010268
7.519861
1.238308
other
Ca2Y2Al6O14
24
35
306.92
mp-1227159
11.303591
7.723895
1.062235
other
Ca2Y2Ga6O14
24
35
328.59
mp-1198222
11.066382
6.939334
-1.517521
other
Na2Nd2Si12O30
46
35
845.79
mp-1227169
11.300962
7.728234
1.038834
other
Ca2Nd2Ga6O14
24
35
336.94
mp-1216381
-6.147603
-3.036296
-2.685153
other
V1Cu3Te2Se2
8
35
191.77
mp-1220452
-4.78206
-1.890997
-4.946642
other
Nb1Cu3Se2S2
8
35
177.19
mp-1218032
-4.974853
-2.04407
-4.902071
other
Ta1Cu3Se2S2
8
35
173.36
mp-1218128
11.260125
7.659444
1.026554
other
Sr2Nd2Ga6O14
24
35
349.53
mp-1341160
9.493586
7.544499
-2.664293
other
Ca2Co2Si4O14
22
35
327.77
mp-1225877
-7.885988
0.600113
4.690203
other
Er2Fe4Co4B2
12
35
150.33
mp-1227113
11.880854
7.577724
1.33791
other
Ca2Pr2Al6O14
24
35
318.25
mp-1217784
11.982832
7.512636
1.331682
other
Sr2Y2Al6O14
24
35
319.52
mp-1653877
8.042807
10.830389
2.13019
other
Sr24Ti12Fe4O56
96
35
1,268.19
mp-1223079
-7.564548
0.733789
5.177711
other
Nd8Ti6Fe50B4
68
35
957.9
mp-1223455
10.546541
11.588302
3.336472
other
K2Sr4Nb10O30
46
35
652.38
mp-1227115
11.90924
7.553399
1.322551
other
Ca2Nd2Al6O14
24
35
315.75
mp-1218016
11.900146
7.535721
1.378356
other
Sr2Sm2Al6O14
24
35
324.72
mp-1225626
-7.563482
-2.032518
2.549946
other
Er1Mn4Fe2Sn6
13
35
233.34
mp-1220411
-5.908796
-2.91376
-2.533951
other
Nb1Cu3Te2Se2
8
35
200.32
mp-1219073
-7.941202
0.492055
4.821622
other
Sm2Fe4Co4B2
12
35
156.86
mp-1227109
11.9352
7.53912
1.277543
other
Ca2Sm2Al6O14
24
35
312.73
mp-1219126
-8.038537
0.708458
4.278277
other
Sm2Fe4Ni4B2
12
35
155.92
mp-1234660
11.541309
12.30093
-2.903466
other
K4Mg1V6O16
27
35
468.21
mp-1225876
-6.487331
-1.484038
4.829617
other
Dy1Mn2Cr4Ge6
13
35
189.5
mp-1225989
-6.650292
-1.280395
4.725461
other
Dy1Mn4Cr2Ge6
13
35
188.34
mp-757939
8.116364
4.349688
-6.819641
other
Li4Fe4C4O16
28
37
361.79
mp-1229197
9.927438
7.184631
-2.379202
other
Al6Si6Pb4O32
48
37
766.11
mp-557855
13.647737
4.784756
-1.890973
other
Ca4Ga4B4O16
28
37
389.2
mp-757345
14.352219
7.317766
-7.121771
other
Li4Mn4P4O16
28
37
365.62
mp-850539
11.305772
7.055174
-1.909304
other
Li4Cr4Si24O60
92
37
1,225.52
mp-1222578
5.441057
-0.471248
-3.009702
other
Li2Sc2B8H32
44
37
435.28
mp-559759
13.673949
4.751291
-1.612736
other
Ca4Al4B4O16
28
37
373.59
mp-758648
7.852193
4.82935
-6.484568
other
Li4Co4C4O16
28
37
345.86
mp-754763
14.018547
7.230983
-3.051652
other
Li4V4B4O16
28
37
343.73
mp-1202656
8.993706
7.31016
-3.479287
other
Cu2Bi4Se6O22
34
39
517.74
mp-643759
9.809075
1.971768
-3.642723
other
Ga2H6N2F6
16
39
148.72
mp-1224071
8.377423
3.918692
-6.39504
other
K10Cu2C2O10
24
39
516.64
mp-1201257
7.560369
6.576052
-2.907057
other
Rb4Bi2I10O30
46
39
853.51
mp-1182682
11.975529
7.466889
0.392862
other
Ca8Al12W2O32
54
39
808.44
mp-27055
13.97276
8.798244
-6.937823
other
Li2V2P2O10
16
39
183.7
mp-1272417
11.480092
10.438698
1.443308
other
Sr4La4V4O16
28
39
394.86
mp-1190417
9.59041
7.693376
-3.793126
other
Y2V2Se4O16
24
39
321.03
mp-1202167
7.566402
6.581969
-2.906712
other
K4Bi2I10O30
46
39
826.59
mp-1147533
8.405886
1.909004
0.237293
other
Bi2B2O2F8
14
39
176
mp-759793
13.53329
6.033691
-7.59579
other
Li4Ti8P12O48
72
33
904.41
mp-1197125
11.689671
7.192342
-3.887489
other
K12Al8As12O48
80
33
1,413.71
mp-1203835
14.590931
7.51868
-5.625739
other
Na16Fe12P16O60
104
33
1,317.62