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-1176980
14.222525
8.487817
-7.438527
other
Li12Mn2V6P12O48
80
7
937.82
mp-1214101
13.070306
5.973423
-0.788043
other
Ca2Al4Si12H8O32
58
7
915.79
mp-1223743
13.84105
5.576292
-7.00227
other
Li4Zr8As6P6O48
72
7
1,077.54
mp-1044021
7.289696
11.784108
1.088613
other
La2Zn2Cr2Fe2O12
20
7
226.26
mp-780775
14.025758
6.716165
-5.739368
other
Sr6Li6Cu6P8O32
58
7
753.64
mp-781789
13.451044
5.509928
-7.337091
other
Li8Nb2In6P12O48
76
7
985.49
mp-1044001
11.133523
11.164506
0.602535
other
La2Mg2Fe2Mo2O12
20
7
240.28
mp-758942
9.069052
3.41892
-5.632933
other
Na4Y4H32C16O48
104
7
1,112.49
mp-758908
9.724903
8.236757
-6.580393
other
Li8Co8P8O32F8
64
7
768.96
mp-1048899
6.91684
11.578566
1.049297
other
Ca2La2Cr2Co2O12
20
7
234.44
mp-1049205
11.725964
10.888325
0.831658
other
La2Mg2Cr2Mo2O12
20
7
238.74
mp-1223591
11.580976
5.744053
-4.54521
other
K2Ga2As6H14O26
50
7
582.91
mp-1226339
12.248366
6.356778
-7.107863
other
K20Mn8B8P20O84
140
7
1,974.6
mp-1226923
13.532813
4.356498
-2.563885
other
Cs2Na2B20H8O36
68
7
768.37
mp-1218539
10.27697
11.019754
2.820487
other
Sr2Ca2Nb2Cr2O12
20
7
248.61
mp-1223877
9.789066
4.425189
-6.070964
other
K4H2S4N2O12
24
7
683.7
mp-731109
2.149013
2.617423
-4.716544
other
Zn4Cu4C2N2Cl14
26
7
655.37
mp-695285
3.443037
2.724648
0.788306
other
Sr2Al2Si10N14O4
32
7
381.46
mp-1576561
12.254019
8.248464
-7.562044
other
Li2V2P4H2O16
26
7
282.51
mp-769493
8.220668
6.343371
-6.143735
other
Na6Ni4P4C4O28
46
7
604.48
mp-1044883
10.354901
10.985825
2.671612
other
La2Mg2Ti2Cr2O12
20
7
227.94
mp-1044050
5.996806
11.106479
-0.360919
other
La2Zn2Fe2Cu2O12
20
7
224.59
mp-1044888
10.557632
11.672476
0.972812
other
La2Mg2V2Cr2O12
20
7
226.14
mp-1044121
8.070553
11.044401
1.175267
other
La2Mg2Fe2Sn2O12
20
7
243.46
mp-1218068
7.56121
10.798162
1.342236
other
Sr2Pr2Zn2Ru2O12
20
7
255.92
mp-743761
14.556406
8.01018
-4.356337
other
Li2Fe6Si2P2O16
28
7
332.16
mp-768689
9.423242
3.853673
-8.624836
other
Li10Fe4P4C4O28
50
7
551.29
mp-41963
6.943397
11.769916
1.465228
other
Ca2La2Mn2Fe2O12
20
7
233.19
mp-40066
6.933779
11.784271
1.45824
other
Ca2La2Mn2Fe2O12
20
7
233.23
mp-690567
8.086198
10.844949
1.571484
other
Ba2La2Mn2Ru2O12
20
7
270.96
mp-1173354
10.553043
3.260609
-4.616148
other
P2H22S2N4O16
46
7
445.01
mp-39159
10.052736
10.884634
2.870842
other
Ca4La4Ti4Cr4O24
40
7
474.81
mp-1223068
12.341917
6.8291
-0.18607
other
Li14Eu16Si8Cl14O32
84
7
1,373.59
mp-1044082
11.817301
11.042912
0.275378
other
La2Zn2Fe2Mo2O12
20
7
256.91
mp-684801
10.045867
10.13859
3.310509
other
Ca2La2Mg2Ta2O12
20
7
252.98
mp-1196190
8.432546
1.43522
-4.491973
other
K2H50C26N4O16
98
7
1,069.04
mp-1043948
7.978482
10.857672
1.366803
other
Ca2La2Fe2Sn2O12
20
7
255.43
mp-769516
8.514007
5.716723
-6.956787
other
Na8Ni4P4C4O28
48
7
607.72
mp-1218181
7.517953
10.986827
1.195779
other
Sr2Nd2Co2Ru2O12
20
7
246.81
mp-556154
7.03125
2.845103
-2.389079
other
As4Se4S12N20F24
64
7
1,091.49
mp-1176965
14.31266
8.520385
-7.288351
other
Li12Mn2V6P12O48
80
7
937.58
mp-1215119
13.381257
8.507214
-1.143806
other
Ca6B10W16Cl4O26
62
7
1,144.28
mp-1043895
7.230696
11.533683
1.348305
other
Ca2La2Cr2Fe2O12
20
7
234.76
mp-1044026
5.845586
11.345774
-0.686003
other
La2Zn2Fe2Ni2O12
20
7
221.91
mp-774506
8.517287
5.727359
-6.950607
other
Na8Ni4P4C4O28
48
7
608.6
mp-1044018
10.515745
10.053308
0.78965
other
La2Zn2Fe2Sb2O12
20
7
249.72
mp-769456
9.573721
3.802511
-8.523633
other
Na10Fe4P4C4O28
50
7
624.39
mp-1043896
7.267962
11.656483
1.223222
other
La2Mg2Cr2Fe2O12
20
7
224.38
mp-1049220
7.080653
11.869815
0.666948
other
La2Zn2Cr2Co2O12
20
7
223.02
mp-768557
8.628532
5.485569
-7.732699
other
Li6Fe4P4C4O28
46
7
522.75
mp-1176959
14.233129
8.494755
-7.439443
other
Li12Mn2V6P12O48
80
7
908.74
mp-775639
13.577796
8.418642
-7.892853
other
Li12Mn4V4P12O48
80
7
914.54
mp-1043924
9.029966
11.691766
1.19363
other
Ca2La2V2Fe2O12
20
7
238.14
mp-758217
10.100931
2.407741
-1.275164
other
Li6V4H8O4F20
42
7
479.98
mp-555254
3.592851
2.763386
-4.087378
other
Mo2C6S4Cl14O2
28
7
742.49
mp-1173171
7.784368
10.789098
1.42283
other
Sr4La4Fe4Sn4O24
40
7
527
mp-1247560
14.743535
8.882936
-6.343562
other
Li8V8P8O32F8
64
7
885.66
mp-542863
12.47571
6.418301
-0.285053
other
Ca14Nb2Si8O34F2
60
7
813.71
mp-1224526
9.589593
2.864568
-4.236767
other
K12Sb4H36S16O18
86
7
1,410.07
mp-1044027
11.832043
10.667601
0.763369
other
Ca2La2Fe2W2O12
20
7
260.2
mp-1044938
11.97028
10.697445
0.656824
other
La2Mg2Cr2W2O12
20
7
241.16
mp-1043975
11.961143
10.758106
0.51023
other
La2Mg2Fe2W2O12
20
7
246.83
mp-684742
10.805761
10.415061
2.757929
other
Sr4La4Ta4Mn4O24
40
7
544.41
mp-1218252
6.834142
11.662797
1.478572
other
Sr2La2Mn2Fe2O12
20
7
239.33
mp-766489
12.78385
5.696272
-3.087517
other
Li6Mn4Fe2B8O24
44
7
464.14
mp-1247833
12.540593
6.608572
-0.954397
other
Al8Si4H2O18F6
38
7
358.89
mp-1220803
9.630289
9.290766
2.524775
other
Na2La2Sc2Sb2O12
20
7
259.64
mp-1220261
9.87501
9.758273
0.711192
other
Nd2Co2Sb2Pb2O12
20
7
264.15
mp-1177559
13.408352
8.413528
-7.967185
other
Li12Mn4V4P12O48
80
7
935.67
mp-1173409
10.17353
3.74765
-4.457036
other
P2H22S2N4O16
46
7
501.14
mp-769600
9.461384
5.515704
-6.891737
other
Li2V4S4O16F12
38
7
584.56
mp-697833
8.076468
10.881636
1.361653
other
Sr2La2Fe2Ru2O12
20
7
251.85
mp-1043854
5.99838
10.922359
-0.288194
other
La2Mg2Fe2Cu2O12
20
7
226.7
mp-1218130
8.068291
10.90416
1.307915
other
Sr2Nd2Fe2Ru2O12
20
7
248.62
mp-769601
10.016295
4.92116
-7.016903
other
Li4V4S4O16F12
40
7
588.98
mp-1221862
10.854378
3.920061
-4.246353
other
Na8As2P2H60O44
116
7
1,088.02
mp-1043865
7.110935
12.125203
1.081749
other
La2Mn2Zn2Fe2O12
20
7
223.87
mp-1177155
9.423931
3.853858
-8.623886
other
Li10Fe4P4C4O28
50
7
551.67
mp-1176544
8.223878
6.329655
-6.140218
other
Na6Ni4P4C4O28
46
7
607.61
mp-1049223
10.668647
10.08542
1.051634
other
La2Zn2Cr2Sb2O12
20
7
250.5
mp-1218222
7.641576
10.89825
1.283209
other
Sr2La2Co2Ru2O12
20
7
254
mp-677482
2.959244
2.291086
1.757154
other
La4Al8Si20N36O4
72
7
848.38
mp-1219623
11.446064
7.090941
-0.880482
other
Rb2Na4Al6Ge6O26
44
7
705.54
mp-648843
5.349026
3.229135
-4.535634
other
Ge6Os12C48Cl24O48
138
7
2,870.01
mp-1220422
2.883073
2.211453
1.785373
other
Nd6Al2Si10N20O2
40
7
513.46
mp-1043991
11.375211
10.666986
2.368189
other
La2Mg2Ta2Fe2O12
20
7
246.18
mp-1218204
7.5583
10.766288
1.390341
other
Sr2La2Zn2Ru2O12
20
7
255.76
mp-1219624
11.861969
6.770153
-1.037549
other
Rb2Na4Al6Si6O26
44
7
659.61
mp-1048855
10.523531
11.529988
1.138878
other
Ca2La2V2Cr2O12
20
7
235.82
mp-1173178
7.544946
10.892686
1.163215
other
Sr2La2Cu2Ru2O12
20
7
255.56
mp-1519157
5.987532
8.545374
-0.08326
original
Sr2Ca2La2Bi2O12
20
7
308.31
mp-699363
8.031887
10.902228
1.528469
other
Sr2La2Mn2Ru2O12
20
7
261.39
mp-774659
9.575318
3.802851
-8.516504
other
Na10Fe4P4C4O28
50
7
625.2
mp-1043917
6.010421
10.570336
-0.245453
other
Ca4La4Fe4Ag4O24
40
7
508.57
mp-557516
12.642318
6.358084
-0.749073
other
K4Be4Zn4Si6O22
40
74
505.36
mp-684782
9.220008
1.318359
1.468364
other
Cs2Ti2Mn2O2F10
18
74
303.5
mp-677732
10.408171
11.345419
2.899401
other
Nd2Ti4Cd2O12F2
22
74
274.19
mp-684730
8.944978
10.771915
1.275502
other
Eu2Ti4Cd2O12F2
22
74
272.91
mp-41837
8.834599
1.14319
1.137312
other
Rb2Ti2Zn2O2F10
18
74
284.79
mp-504945
10.267058
2.385555
-2.635997
other
Mn2Fe2H8O4F10
26
74
285.13