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-1213196
10.516177
7.75637
-1.43561
other
Eu4Ga4Ge8O28
44
14
567.53
mp-1212319
4.701286
2.311091
-3.306627
other
K8C28N16O4
56
14
999.72
mp-1192852
7.160223
6.206317
-4.484398
other
S4N4Cl4O16
28
14
494.5
mp-558716
2.035281
2.689067
-4.47258
other
W4S4N4Cl20
32
14
946.47
mp-1203985
7.381092
7.012877
-4.224815
other
Mg4U4Se8O60
76
14
1,257.79
mp-766413
9.983637
11.285496
0.168939
other
K8Li12Cr4O16
40
14
521.79
mp-1199075
8.803853
2.776176
-4.654148
other
H24C8S8O24
64
14
856.49
mp-757887
13.085919
6.465752
-0.953464
other
Li8Co4Si16O40
68
14
943.79
mp-1198324
13.512124
4.447602
-2.455241
other
Li8B32Se4O60
104
14
1,231.64
mp-727096
10.128868
7.345855
-6.219696
other
Ba4Tl4P12O44
64
14
1,078.41
mp-1197882
7.834937
7.002188
-4.437417
other
Cs4U8As8O72
92
14
1,787.21
mp-555652
10.241672
4.35565
-7.078357
other
K8Zn4S8O32
52
14
795.51
mp-1211340
13.825891
4.867198
-2.119732
other
Li24Tm4B12O36
76
14
761.1
mp-757796
10.63753
4.362101
-5.317099
other
Al8H40S12O68
128
14
1,258.55
mp-1204941
9.487767
1.995728
-4.312654
other
P8H40C8O24
80
14
882.43
mp-1516990
5.880031
8.453319
-0.087876
other
Sr4Pr2Bi2O12
20
14
323.82
mp-706979
9.171348
1.723855
-4.241285
other
P4H24N12O4
44
14
414.99
mp-1208136
7.909352
2.935624
-4.825946
other
V4H12C16O24
56
14
689.02
mp-775486
13.999916
7.222707
-5.728748
other
Li12Sb8P12O48
80
14
1,099.34
mp-776243
9.949208
8.261825
-6.737127
other
Li4Mn8P12O48
72
14
847.03
mp-1208705
8.755581
1.579346
0.489912
other
Sr4Si4H8F24
40
14
609.35
mp-18899
7.581329
11.590585
1.856864
other
Nd4Mn2Ni2O12
20
14
236.2
mp-1195328
10.232427
4.076304
-5.189772
other
H20S8N4O28
60
14
687.99
mp-1211597
7.978514
10.551474
1.551893
other
La4Cu2Ir2O12
20
14
256.36
mp-540750
13.636817
6.430094
-6.275929
other
Cs4Nb4P8O32
48
14
804.28
mp-1197414
9.571984
5.777278
-4.27423
other
Ca4H16Se8O36
64
14
760.82
mp-743256
2.140079
3.006165
-4.513178
other
K4I4Cl16O4
28
14
844.47
mp-1209173
-4.044406
-1.216163
-5.484699
other
Rb4Cu4Te4S12
24
14
633.15
mp-1193276
7.756517
3.056239
-1.325401
other
Ti2Zn2O12F12
28
14
403.64
mp-746691
9.710581
3.460855
-4.03162
other
Co4H32Cl8O16
60
14
763.14
mp-860971
10.721663
4.261605
-6.79353
other
Er4H4S8O32
48
14
615.31
mp-1208459
12.841334
8.825913
-5.527648
other
Tl6Mo8P8O44
66
14
1,009.43
mp-1203811
10.066731
6.003528
-3.489951
other
Sm4B28Cl4O72
108
14
1,382.06
mp-1047950
9.294931
0.661908
0.13793
other
Ba4Zn4Ni4F28
40
14
537.43
mp-1201606
11.505244
6.718262
-2.645324
other
B4P4Pb16O32
56
14
890.29
mp-768756
13.794975
4.369368
-2.309698
other
Li8Bi4B20O40
72
14
864.51
mp-759866
7.34488
1.070149
-4.343365
other
Te4H12C4Cl12
32
14
671.4
mp-560369
10.702916
11.038936
1.4382
other
La4Mn2V2O12
20
14
257.46
mp-23674
10.056297
2.982993
-3.917986
other
Na4H16Br4O8
32
14
434.03
mp-1204488
8.468578
3.041574
-5.193725
other
Cu6H20C16O28
70
14
689.7
mp-15520
13.929852
4.276887
-2.285018
other
Tb4Zn4B20O40
68
14
626.57
mp-560406
11.449698
11.022916
-3.715105
other
K16Zr2Mo12O48
78
14
1,479.35
mp-721624
13.226179
5.334053
-6.054264
other
Ca20P12H4O52
88
14
1,049.17
mp-1196903
12.815904
6.95597
-6.265625
other
Cr4P8Pb6O32
50
14
663.4
mp-1182743
7.758312
6.509918
-4.828636
other
Na8Th4S12O72
96
14
1,599.9
mp-1180350
8.192744
2.988477
-1.351594
other
Mg2Si2O12F12
28
14
394.12
mp-1197166
2.766614
2.93092
-3.733152
other
Sb8N16Cl24F16
64
14
1,944.26
mp-1041184
9.749195
7.524425
-2.810986
other
Be12Cu8Si12O48
80
14
834.4
mp-582540
10.404827
10.752707
-4.15493
other
Eu4Mo4O16F4
28
14
408.99
mp-558202
9.184865
7.229021
-3.550324
other
Fe4Cu6Se12O36
58
14
815.8
mp-1237301
11.100596
5.532473
-5.48042
other
Nd4P8H12O24
48
14
660.55
mp-559244
11.978042
6.814582
-7.301697
other
Sr8Mn4P12O44
68
14
858.15
mp-759823
11.461284
7.45485
-7.233698
other
Li12Cu12P12O48
84
14
1,010.71
mp-6726
10.352562
4.246525
-7.200987
other
Cs4Li4S4O16
28
14
478.05
mp-1040928
9.311609
10.767014
-1.491538
other
Mg4Cu8Sb8O32
52
14
705.42
mp-706590
7.890643
0.9011
-4.17922
other
Na4Al4H32N16
56
14
627.8
mp-559604
6.175137
3.393251
-4.531256
other
Mn4C20O16F8
48
14
775.36
mp-757972
14.309838
8.043906
-6.86846
other
Li8V4P12O40
64
14
960.99
mp-1203200
8.548031
1.272859
0.773531
other
Al4Pb12O4F36
56
14
820.15
mp-1198489
7.920876
6.57009
-3.579226
other
Hg12H16I8O48
84
14
1,075.69
mp-757817
14.603787
7.80472
-4.975729
other
Li8Nb4P8O32
52
14
624.39
mp-1301773
7.851097
12.398235
-1.013999
other
Zn4Fe2Ir2O12
20
14
210.8
mp-1194740
11.992443
7.227877
-0.380054
other
Li4Sc4Ge8O24
40
14
489.07
mp-1364209
7.843577
11.387724
0.567826
other
Ca8Nb8Co4O36
56
14
688.79
mp-1218131
13.375099
5.802539
-7.294607
other
Ta2Bi2P8O28
40
14
611
mp-32495
14.614421
8.635247
-6.498192
other
Li6V6P8O32
52
14
590.41
mp-1196502
11.294654
4.423533
-3.974703
other
Rb16Nb12H56O66
150
14
1,903.97
mp-1350689
13.293877
8.191815
-3.225826
other
Mg6Ti6As8O32
52
14
652.55
mp-1199164
10.094998
7.543052
-6.180492
other
Bi4P16N4O48
72
14
1,014.14
mp-558576
8.351917
2.339926
-0.907535
other
Re4Sb4O8F32
48
14
764.11
mp-780866
13.230754
7.436753
-1.257928
other
Li4Fe8Si8O28
48
14
654.48
mp-1211744
13.705619
5.230121
-6.751823
other
K4Tm4P8O28
44
14
709.52
mp-557333
8.322762
0.865452
-4.407425
other
H56C20S8N8
92
14
949.42
mp-1207494
12.359867
6.443492
-5.62112
other
Zn12Ag12P12O48
84
14
1,158.3
mp-729187
4.595981
3.166744
-3.495836
other
Zn8C16N64O4
92
14
1,838.03
mp-1041345
8.339143
1.317204
1.352892
other
Ba4Ca4Bi4F28
40
14
647.77
mp-772438
13.114262
7.710244
-7.125468
other
Li8Co8P8O32
56
14
604.94
mp-1191326
10.3581
9.43329
-1.97511
other
In4Te4Br4O12
24
14
440.93
mp-1194286
9.300077
7.542683
-4.58358
other
Mg2Al4P4O20
30
14
333.97
mp-6500
8.272799
0.910641
1.821844
other
K2Rb4Sc2F12
20
14
359.61
mp-1020606
13.108459
5.502815
-6.348668
other
Sr4Be8P8O32
52
14
624.11
mp-1202937
8.037479
0.490209
-4.494272
other
Al12H96C24N12
144
14
1,701.67
mp-600220
9.129979
3.479121
-5.63851
other
In4H24C12O36
76
14
788
mp-1199622
12.208341
5.354693
-5.413565
other
Zr4P8H16O36
64
14
803.94
mp-1204611
12.820326
5.771619
-1.068275
other
Th8B4P4O32
48
14
553.45
mp-695816
11.354681
7.831467
-7.736661
other
Li4Fe4P8O28
44
14
572.73
mp-1202217
10.229974
4.26125
-7.118167
other
Rb8Li8S8O32
56
14
823.84
mp-24537
10.18789
2.994859
-3.900742
other
Fe2H16Br4O8
30
14
385.14
mp-758793
11.704832
7.39452
-2.200216
other
Li8Cu4Si4O16
32
14
344.1
mp-540903
4.685618
2.727094
-3.673584
other
Cd4C8S8N8
28
14
570.73
mp-561127
6.175284
5.002519
-4.481466
other
K4Ce2N12O36
54
14
683.85
mp-697653
9.907207
1.75553
-3.691785
other
Mg4H32N8F16
60
14
470.08
mp-730473
11.653447
5.226042
-5.285303
other
Cu4P8H16O24
52
14
640.09
mp-683660
5.741206
3.498989
-4.64346
other
Mn8C32Br8O32
80
14
1,437
mp-1198271
11.923449
4.619195
-5.19247
other
Li16P8H24O32
80
14
844.81
mp-755745
9.477085
7.258817
-3.822984
other
Li2Bi2B4O12
20
14
222.24
mp-758124
8.015303
4.641259
-6.652716
other
Li4Co4C8O24
40
14
559.21
mp-1211593
13.135532
5.337193
-0.643016
other
Li4Er24B12O56
96
14
1,137.77
mp-556601
12.556869
5.843295
-2.307553
other
Bi4B4Pb4O16
28
14
430.26
mp-758568
7.932078
4.689344
-7.274067
other
Li4Mn8C8O32
52
14
548.97