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-556551
9.512645
6.968752
-3.302583
other
Gd4Se4Cl4O12
24
62
471.43
mp-631621
10.819911
10.295706
-2.235668
other
V4Bi4Pb8O24
40
62
725.47
mp-1194448
-3.607607
-0.938572
-5.009854
other
Cs8Mo4S12O4
28
62
947.93
mp-766701
12.004676
7.458996
-1.643202
other
Li8Si4Ni4O16
32
62
337.83
mp-1214827
-4.48278
-3.421277
-3.596375
other
Ba28Sn12Te12Se40
92
62
3,212.93
mp-1208422
7.86185
10.27396
-3.688465
other
Tl4Cr8Fe4O32
48
62
730.23
mp-759980
14.462561
12.409501
-0.648152
other
Li4V12O16F8
40
62
437.33
mp-756789
13.492019
6.994634
-0.869575
other
Li12V4Si24O60
100
62
1,175.23
mp-1224154
12.791686
6.42029
-6.224763
other
K8P8Pd4O28
48
62
756.06
mp-1192825
13.717305
8.067904
-0.982556
other
Mg4Fe4Si4O16
28
62
296.42
mp-22550
9.178868
8.739003
2.77059
other
Ba4Dy8Cu4O20
36
62
506.22
mp-1276679
10.588214
11.101314
1.828716
other
Sr8Zr4V4O24
40
62
532.12
mp-1204297
0.925251
2.26793
-3.991025
other
K16Bi8Br40O16
80
62
2,572.97
mp-758188
13.663303
8.233097
-0.745746
other
Li8Cr4Si4O16
32
62
347.7
mp-1211815
-3.604947
-4.556979
0.905387
other
K4Ga4P8H8
24
62
602.18
mp-1181403
3.175321
3.147786
-3.904658
other
Fe4N8Cl20O4
36
62
981.9
mp-24337
9.616081
2.716994
-3.776019
other
Mg4H8Cl8O4
24
62
384.07
mp-1238862
-5.183413
-0.161256
-5.57277
other
Ti4Cr4Cu4S16
28
62
471.97
mp-756284
13.425778
5.473402
-3.029091
other
Li4Co4B4O12
24
62
267.8
mp-541007
10.241768
8.902141
2.547577
other
Ba4Dy8Mn4O20
36
62
524.08
mp-561999
8.69666
0.557345
0.818111
other
Cs4Al4Ag4F24
36
62
587.1
mp-831260
14.273396
7.737248
-6.910718
other
Li4Mn16P12O48
80
62
1,069.88
mp-1201372
9.93596
8.639861
2.56481
other
Li4Sm4Eu8O16
32
62
474.47
mp-26967
14.791774
8.154402
-5.37532
other
Li4Cr16P12O48
80
62
954.78
mp-1200775
8.519812
7.909078
-2.700266
other
Al8Si8Pb4O40
60
62
642.86
mp-1195873
9.553487
2.247736
0.850697
other
K8V8O8F24
48
62
759.16
mp-1199033
1.84968
2.910696
-5.019373
other
K8Tc4Cl20O4
36
62
969.2
mp-1192434
8.426637
7.786437
-2.532456
other
Na4Yb4Si4O16
28
62
389.67
mp-1094134
9.504696
11.801576
-1.210983
other
Li4Ni4Sb4O16
28
62
334.78
mp-562018
8.188793
2.632255
-1.570982
other
C4S4N4F20
32
62
509.24
mp-1213491
2.906946
3.099327
-4.15619
other
Fe4H4N8Cl20
36
62
1,049.24
mp-1288318
8.434874
11.545852
2.29891
other
Sr8Mn4Nb4O24
40
62
524.46
mp-558548
13.320626
4.531254
-2.617921
other
Na12B24N4O52
92
62
949.09
mp-6712
11.758731
7.301986
0.23258
other
Na4Lu4Ge4O16
28
62
381.57
mp-1198777
11.029898
11.158168
-2.324475
other
Er4Bi4W8O36
52
62
736.51
mp-1176761
14.764376
7.85636
-5.551712
other
Li4Fe4P4O16
28
62
299.77
mp-6651
8.620692
1.738271
0.788482
other
K8Ta8O12F24
52
62
875.75
mp-1210123
12.077191
6.694312
0.399442
other
Na4La4Si4O16
28
62
378.02
mp-16927
11.640667
7.375174
0.173769
other
Na4Tb4Ge4O16
28
62
404.2
mp-6121
9.490788
8.632875
2.922329
other
Ba4Y8Zn4O20
36
62
515.87
mp-1197087
9.797091
7.776388
-6.376631
other
Mn12B4P4O40
60
62
634.05
mp-1202682
-5.591796
-6.843807
3.843573
other
Li4Ca28Ge12H12
56
62
1,183.35
mp-753327
12.202104
7.217858
-1.049526
other
Li4Si4Bi4O16
28
62
362.73
mp-560851
8.230979
1.984257
-0.743735
other
Cs4I4O4F16
28
62
566.69
mp-556255
10.821088
9.249446
-4.98686
other
K12V12As8O56
88
62
1,371.86
mp-7205
12.639542
6.732134
-0.729755
other
Li4In4Si4O16
28
62
321.62
mp-1195869
2.015097
2.981048
-4.986255
other
K8Ru4Cl20O4
36
62
939.45
mp-6160
13.010399
5.716207
-5.927476
other
Rb8P4O12F4
28
62
506.69
mp-24463
10.051699
4.114822
-4.917019
other
H12S4O16F4
36
62
412.96
mp-18169
13.369902
5.977639
-5.364233
other
Rb4Eu4P4O16
28
62
444.62
mp-6633
4.76468
2.729
-3.611047
other
Na4C4S4N4
16
62
318.64
mp-1044783
12.203902
6.666345
-5.576412
other
Zn4Bi8P8O36
56
62
839.09
mp-1213677
-1.069544
1.144021
-1.669564
other
Cs4La24Fe4I40
72
62
3,196.79
mp-727834
7.246718
6.33531
-3.024166
other
Sr8Cd8I32O64
112
62
2,762.07
mp-1210608
13.536738
7.718534
-0.817398
other
Mg4Mn4Si4O16
28
62
321.16
mp-6419
13.42352
5.152908
-1.804635
other
Ca4Si8B8O32
52
62
564.06
mp-1194626
8.306855
2.012365
-0.704111
other
K4Co4As12F72
92
62
1,465.96
mp-630403
7.938938
11.634295
1.951331
other
Ca8Mn4Ga4O20
36
62
439.1
mp-726340
8.307451
2.138959
-0.937718
other
Co4As12O4F72
92
62
1,395.41
mp-600174
9.086413
3.504092
-5.553702
other
H16Pb4C8O24
52
62
599.32
mp-1210202
1.790326
2.418867
-4.584637
other
Na4Hg4H8Cl12
28
62
646.35
mp-1246393
-4.761558
-0.470189
-5.30686
other
Zr4Cr4Cu4S16
28
62
604.8
mp-770629
8.88333
12.555367
-0.678823
other
Li8Al4Fe4O16
32
62
334.6
mp-560208
11.595311
7.486647
-3.938813
other
K12Nb4As8O36
60
62
1,020.01
mp-1013843
14.123561
8.889818
-4.401915
other
Na4Mo8P8O36
56
62
776.94
mp-1040941
11.474846
7.646645
-7.405725
other
Ca4Fe8P8O36
56
62
666.56
mp-558362
11.855806
7.33892
-0.200198
other
Ca4Mg4Ge4O16
28
62
371.04
mp-761755
12.615518
7.239287
-7.017531
other
Li4Cu4P12O36
56
62
780.62
mp-504871
10.532564
12.279519
-3.692867
other
Sr4V8Cu4O28
44
62
612.19
mp-1200007
11.042089
7.723746
-4.393324
other
Rb8Fe8As8O36
60
62
978.48
mp-1210557
9.754099
4.892715
-6.968278
other
Na4Cr4S8O32
48
62
607.18
mp-560714
12.414301
8.757683
-5.079915
other
Ba4V16As16O76
112
62
1,563.65
mp-706586
8.300524
4.557157
-4.020146
other
H16N4Cl4O16
40
62
401.37
mp-557798
8.362661
0.9257
1.722615
other
K20Li8Nd4F40
72
62
1,156.91
mp-556345
6.215666
5.109405
-4.399623
other
Ag8Br4N4O12
28
62
472.24
mp-561304
-3.540601
-1.256276
-5.483439
other
K8Ag24As16S40
88
62
2,164.94
mp-505743
13.178339
5.238053
-2.342603
other
Ga4B4Pb4O16
28
62
357.97
mp-758828
11.709398
7.426898
-7.284168
other
Li4Cu4P4O16
28
62
294.82
mp-757301
13.858871
6.936313
-5.516717
other
Li4Sn4P12O36
56
62
962.74
mp-556349
9.733356
8.260991
-3.580289
other
Rb8Mo4Se4O24
40
62
696.16
mp-699469
8.849805
1.205686
-4.046013
other
Al4H60N20Cl12
96
62
991.23
mp-1214119
7.236345
8.614256
-0.175381
other
Ca8La4Be4O20
36
62
449.66
mp-6495
9.654721
8.55481
3.112039
other
Ba4Er8Zn4O20
36
62
501.92
mp-541574
8.944753
9.079299
2.656344
other
Ba4Y8Co4O20
36
62
511.79
mp-17832
12.958124
5.730945
-5.481755
other
Rb4Ba4P4O16
28
62
473.66
mp-1202177
-3.398498
-4.588067
0.780618
other
Rb4Na32Ga12P24
72
62
1,755.44
mp-758930
9.581582
10.016231
0.029155
other
Na40Fe8H8O32
88
62
1,239.26
mp-1097049
10.46349
8.309617
-7.537115
other
Li4Mn8P8O36
56
62
659.59
mp-1221755
13.970825
8.519164
-1.149743
other
Mn4Fe4Si4O16
28
62
327.84
mp-1197381
7.907917
0.331714
-4.495597
other
As4H40C12I4
60
62
848.55
mp-25449
12.1814
7.316466
-7.258692
other
Li4Cu4P4O16
28
62
289.21
mp-1196988
8.353434
0.915815
1.696701
other
K20Li8Pr4F40
72
62
1,157.88
mp-1040876
14.207542
8.780346
-4.006697
other
Ca4Mo8P8O36
56
62
758.21
mp-736223
1.601218
2.790187
-5.495885
other
Cs8In4Cl20O4
36
62
1,259.85
mp-1222069
12.957596
8.102178
-0.90368
other
Mg4Mn4Ge4O16
28
62
338.63
mp-1205236
9.01311
10.9922
-3.562767
other
V4Zn4Pb4O20
32
62
627.47
mp-560982
6.352376
5.099617
-4.514645
other
K8Cd4N16O32
60
62
1,001.73
mp-1198086
8.149379
8.394981
-4.065948
other
Mg4U8Cr8O64
84
62
1,377.25
mp-583297
-3.092518
-1.358397
-5.412313
other
Ba24Nb16S52O12
104
62
2,837.99
mp-1195089
8.254954
1.905516
-0.515475
other
K4Mg4As12F72
92
62
1,475.48