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-757828
10.406253
8.138818
-7.291989
other
Li8Mn8P8O40
64
33
787.05
mp-555816
9.098274
6.757448
-3.849015
other
K8Dy8Se16O64
96
33
1,450.61
mp-15108
11.616795
7.345516
-4.201983
other
Rb8Sn8As8O40
64
33
1,023.97
mp-1214635
9.205727
0.708897
0.841803
other
Ba8Na8Fe8F48
72
33
1,109.89
mp-556503
9.067184
3.113766
-5.246414
other
Li4H12C4O12
32
33
323.23
mp-780331
14.444658
7.33276
-7.071651
other
Li4Mn4P4O16
28
33
358.17
mp-860963
10.081334
4.69441
-5.793485
other
Ag8H16S12O48
84
33
1,057.27
mp-1218318
7.358813
8.873668
0.003927
other
Sr4Eu8Be4O20
36
33
464.35
mp-555825
12.873034
6.370634
-0.296968
other
Na16Sc8Si16O52
92
33
1,077.12
mp-6394
11.794861
7.389768
-4.217761
other
Rb8Ti8As8O40
64
33
959.55
mp-1211958
13.388865
4.672226
-1.443917
other
Sr12Gd8B16O48
84
33
1,074.08
mp-1223741
12.963333
5.994101
-0.933433
other
K4Si8H4O20
36
33
513.9
mp-23931
11.930411
4.762001
-5.411809
other
Li4P4H8O12
28
33
301.87
mp-1224482
9.519002
6.583266
-3.897019
other
In4H4Se4O16
28
33
373.57
mp-1198062
9.83373
7.182027
-2.334432
other
Li4Al4Si4O20
32
33
437.02
mp-780724
13.84441
7.101714
-6.095506
other
Li8Sb8P16O56
88
33
1,198.38
mp-6426
12.537287
6.207936
-0.667425
other
Na8Mg4Si4O16
32
33
400.35
mp-758616
11.363235
7.468998
-7.276187
other
Li4Cu4P4O16
28
33
349.73
mp-639714
10.578359
11.045424
-2.942818
other
Tl4V4Te4O20
32
33
517.13
mp-1201876
10.679068
7.705225
2.966325
other
La16Fe8Se16O16
56
33
1,177.35
mp-568759
-1.119672
1.66707
-1.910758
other
Na4Nd16I28N8
56
33
1,967.32
mp-6488
11.848812
7.399143
-4.305059
other
K8Ti8As8O40
64
33
974.5
mp-1352057
1.38516
2.060299
1.262247
other
Ba4Ca8Co8N16
36
33
861.01
mp-766229
13.710932
8.440147
-0.751905
other
Li12V4Si4O20
40
33
437.31
mp-21724
12.036818
6.709915
-0.985702
other
Zn8Si8Pb8O32
56
33
831.04
mp-557237
12.683183
6.19524
-0.623359
other
K20In12Si28O84
144
33
2,265.06
mp-1200391
13.542958
4.580687
-2.462196
other
K16Nb16B32O96
160
33
2,250.81
mp-1227164
9.903996
8.569411
2.789338
other
Ca4Pr8Be4O20
36
33
456.11
mp-758602
11.593364
7.43048
-2.159698
other
Li4Fe4Si4O16
28
33
358.22
mp-561743
12.761055
7.274701
-1.516448
other
Li8Co4Si4O16
32
33
341.77
mp-766496
12.007744
7.46107
-1.647753
other
Li8Si4Ni4O16
32
33
343.27
mp-768849
14.514155
6.862514
-2.707026
other
Li12V4B4O20
40
33
379
mp-753749
13.772458
8.465571
-0.963789
other
Li4V4Si4O16
28
33
361.65
mp-1195603
-4.27364
-1.282295
-5.739068
other
Li8Mn4Sn4S16
32
33
700.19
mp-24468
9.907538
2.522938
-4.486637
other
H32S4N8O16
60
33
488.95
mp-1214564
8.981668
1.15249
1.203927
other
Ba8Na8Cr8F48
72
33
1,108.59
mp-765622
10.34582
2.117029
1.0845
other
Li8V4O4F16
32
33
377.47
mp-1195993
12.594435
4.221709
-3.031404
other
Mg4B24H40O60
128
33
1,193.69
mp-1209534
13.472017
4.73595
-1.400168
other
Sr12Sm8B16O48
84
33
1,082.45
mp-6803
13.471803
4.692085
-1.43467
other
Sr12Pr8B16O48
84
33
1,107.07
mp-757330
10.67824
8.224761
-6.945686
other
Li8Cr8P8O40
64
33
818.23
mp-831162
11.474657
7.350695
-2.393537
other
Li4Mn4Si4O16
28
33
342.29
mp-644256
8.094348
4.289601
-5.425444
other
Li4H8C4O12
28
33
321.63
mp-757770
14.659842
7.171103
-6.115041
other
Li12Mn4P4O20
40
33
444.85
mp-22743
7.418603
12.049969
-1.024436
other
Ba4Yb4Co16O28
52
33
726.4
mp-757945
14.115746
7.182222
-5.334955
other
Li12Sn12P12O48
84
33
1,178.39
mp-1202651
12.486599
8.737384
-5.295953
other
K8V8As8O40
64
33
956.15
mp-1199982
7.84534
7.396436
-4.22326
other
Rb8U4Se8O48
68
33
1,280.89
mp-1198407
13.926568
5.806414
-6.482035
other
K8Ti8P8O40
64
33
859.53
mp-2646917
6.433658
0.366753
-3.511395
other
Na4B36H40C4
84
33
878.13
mp-1215092
8.835719
1.804577
1.537346
other
Ba8Na8Ti8F48
72
33
1,126.27
mp-757040
14.751143
7.89017
-5.336647
other
Li4Cr4P4O16
28
33
363.75
mp-757667
14.347049
7.46646
-6.862935
other
Li12Mn12P12O48
84
33
947.93
mp-26041
14.798497
7.741754
-5.575345
other
Li4Fe4P4O16
28
33
359.61
mp-26057
14.418687
7.274039
-7.111929
other
Li4Mn4P4O16
28
33
363.51
mp-560780
12.441569
7.050935
-7.155861
other
Na16Ni12P16O60
104
33
1,258.46
mp-1195092
10.922622
11.088494
-0.20681
other
Mn4Pb8W4O24
40
33
572.2
mp-1226851
11.018291
10.88775
3.040154
other
Ce4Ta4Ti4O24
36
33
454.05
mp-1193774
11.305892
6.800599
-5.183547
other
Mn4P4C4O16
28
33
506.17
mp-1205023
8.605289
9.552777
1.135396
other
Sr32Mn16Bi32O104
184
33
2,923.22
mp-758595
13.698317
8.285787
-0.712929
other
Li8Cr4Si4O16
32
33
362.43
mp-560015
10.743878
9.182929
-4.589808
other
Li4Mo4As4O24
36
33
435.86
mp-766472
10.350848
7.991087
-2.745311
other
Li12Si4Ni4O20
40
33
417.36
mp-761051
11.96078
8.391915
-7.19298
other
Na8V4P4O24
40
33
510.39
mp-758297
11.91131
7.573687
-7.509381
other
Li4Ni4P4O16
28
33
346.97
mp-770733
8.954526
12.350374
-0.654596
other
Li8Al4Fe4O16
32
33
360.74
mp-768521
13.525201
6.585958
-3.229484
other
Li12Cr4B4O20
40
33
374.29
mp-757465
14.780766
7.837206
-5.494975
other
Li4Fe4P4O16
28
33
354.23
mp-758268
14.003331
8.093426
-7.332686
other
Li16V4P8O36
64
33
734.98
mp-6268
13.907226
5.784957
-6.437606
other
K8Ti8P8O40
64
33
864.98
mp-570577
2.860209
2.301605
1.730073
other
Sr8Al8Si32N56
104
33
1,249.7
mp-779305
13.138864
5.902305
-2.861604
other
Li8Fe4B4O16
32
33
309.34
mp-15515
8.811608
0.989868
1.52236
other
Ba8Na8Al8F48
72
33
1,050.99
mp-1222236
10.675858
7.271245
-1.778846
other
Mg12Si4O20F4
40
33
444.4
mp-648912
5.660815
3.288377
-4.726284
other
Os20C60S4O60
144
33
2,415.19
mp-558807
-2.586745
-0.482548
-5.483394
other
Zn4Ag4P4S16
28
33
603.07
mp-766664
11.343246
7.8053
-2.301835
other
Li12Fe12Si12O48
84
33
846.95
mp-1196152
7.606211
0.493199
-4.044666
other
Y4B12H96N16
128
33
1,312.2
mp-1020023
12.477481
7.062485
-0.461878
other
Li12Al4Si4O20
40
33
408.07
mp-758991
11.681397
7.407818
-2.115211
other
Li8Fe8Si8O32
56
33
780.75
mp-753797
13.782109
8.466725
-0.951912
other
Li4V4Si4O16
28
33
366.86
mp-504304
11.472998
7.448351
-7.310655
other
Li4Cu4P4O16
28
33
338.81
mp-759261
9.962959
7.802361
-3.04107
other
Li4Co4Si4O16
28
33
357.5
mp-705312
14.859444
7.858427
-5.408755
other
Li12Fe12P12O48
84
33
882.04
mp-764340
13.756538
8.060819
-0.897362
other
Li8Fe4Si4O16
32
33
359.99
mp-768020
13.439065
7.56475
-0.77247
other
Li8Mn4Si4O16
32
33
351.92
mp-758743
11.644477
7.411386
-2.244199
other
Li8Cu4Si4O16
32
33
343.81
mp-24614
9.888776
1.809181
-3.722975
other
Be8H64N16F32
120
33
918.86
mp-1350317
1.61743
1.945
0.999352
other
Ba4Ca12Cu8N16
40
33
859.9
mp-728279
5.629581
3.340885
-4.67452
other
Os20Pd4C64O64
152
33
2,785.07
mp-726898
3.52852
3.578956
-3.9747
other
Ru4N16Cl12O8
40
33
984.62
mp-1200479
7.899301
11.747556
-0.481846
other
Ba4Lu4Co16O28
52
33
713.52
mp-6706
13.885999
6.20447
-6.422751
other
Ti8Tl8P8O40
64
33
922.38
mp-1218200
9.848388
8.562436
2.79905
other
Sr4Nd8Be4O20
36
33
464.86
mp-554288
11.716516
4.577423
-4.82731
other
Na4P4H16O20
44
33
455.14
mp-772673
12.178171
7.434662
-7.28988
other
Li4Ni4P4O16
28
33
348.71
mp-1220624
10.142126
8.612071
2.765313
other
Nd8Eu4Be4O20
36
33
462.79
mp-1176767
11.756305
7.384465
-7.284822
other
Li12Cu12P12O48
84
33
891.94
mp-770151
15.145006
7.08476
-2.049767
other
Li8V4B4O16
32
33
312.63
mp-778997
11.908152
7.448431
-2.031904
other
Li12Mn4Si4O20
40
33
436.41