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-1101520
13.260975
7.746667
-7.400749
other
Li4Cr4P8O28
44
14
497.37
mp-774306
10.736526
8.198242
-7.005107
other
Li4Cr4P4O20
32
14
346.62
mp-757520
12.935311
7.671619
-7.225646
other
Li8Co8P8O32
56
14
640.78
mp-1369592
11.771808
10.428789
0.488386
other
Ca4Sb2W2O12
20
14
273.59
mp-557248
8.666121
2.407178
-4.538437
other
H28C4N12O12
56
14
501.32
mp-1195568
-3.130519
-1.907282
-5.446009
other
Ba16In4Ag4S24
48
14
1,389.73
mp-757886
10.160801
4.51342
-6.652124
other
Nd4H4S12O44
64
14
898.72
mp-558538
9.923194
7.021817
-3.330712
other
Ho4Se4O12F4
24
14
331.1
mp-1208845
5.923503
8.501021
-0.030306
other
Sr4Ho2Bi2O12
20
14
306.39
mp-849321
13.37946
6.59385
-0.788737
other
Li8Mn4Si16O40
68
14
980.88
mp-1197607
13.125103
5.460658
-6.210621
other
K36Al12P24O96
168
14
2,756.09
mp-753778
8.757423
3.612331
-7.697445
other
Li4Cr2C4O12
22
14
267.32
mp-557540
-3.552153
-1.485744
-5.357676
other
Rb8Ag4Sb4S16
32
14
979.68
mp-757030
14.960084
7.974823
-5.353058
other
Li8Cr8P8O32
56
14
636.1
mp-1022809
9.305847
10.123754
2.823798
other
Ba16Nb4Fe4O32
56
14
958.91
mp-1180593
9.623251
6.181327
-3.888189
other
K4H12Se8O24
48
14
681.93
mp-1199320
13.331067
6.794036
-6.894102
other
Na8Cr4P8O30
50
14
665.71
mp-6592
6.316443
5.042312
-4.462312
other
K8Pt4N16O32
60
14
983.51
mp-559535
8.33409
1.156091
-4.594137
other
H20C8Cl4O4
36
14
433.51
mp-1195399
8.124615
2.041126
-0.581792
other
Hg4Sb8Xe20F88
120
14
2,583.23
mp-10499
14.111465
5.209436
-7.52936
other
Li4Zr8P12O48
72
14
978.47
mp-1047142
7.077843
11.153229
0.016205
other
Ca4Ni2Ir2O12
20
14
236.33
mp-616455
2.173075
2.884753
-4.407378
other
Te4Mo4Cl28O4
40
14
1,193.85
mp-1200323
11.641735
7.4594
-4.054996
other
Na12Nb4As8O36
60
14
822.37
mp-17924
12.609424
6.229253
-6.06887
other
Zn4P8Pb4O28
44
14
595.78
mp-26088
8.749224
7.981352
-5.10313
other
Li4Co8P12O48
72
14
901.52
mp-1196111
6.97298
6.431538
-4.088395
other
Ni4H8Cl8O16
36
14
663.99
mp-1228427
7.32977
8.443843
0.820254
original
Ba4Ce2Bi2O12
20
14
347.46
mp-696396
8.86276
3.62271
-6.469866
other
Na4H4C4O12
24
14
259.97
mp-1653381
8.315113
13.379842
-0.752543
other
Li16Ti4Cr4O24
48
14
431.34
mp-647305
10.527625
7.800984
-2.566621
other
Si16Ag80Cl16O64
176
14
2,892.35
mp-557845
-3.397709
-1.61146
-5.88151
other
Na8Ti4S8O4
24
14
506.12
mp-1041173
9.111241
7.713733
-2.894511
other
Be12Si12Ag8O48
80
14
936.34
mp-1209104
7.986201
3.015969
-4.910642
other
Sm4H16C24O32
76
14
836.1
mp-1197584
9.141285
6.250965
-4.009713
other
Cs4H12Se8O32
56
14
953.03
mp-1041302
9.213857
0.681069
0.285747
other
Ba4Zn4Cu4F28
40
14
538.71
mp-555802
9.290909
7.048002
-3.564291
other
Zn6Fe4Se12O36
58
14
841.81
mp-1247738
7.597572
11.90685
1.844318
other
Lu4Mn2Co2O12
20
14
216.96
mp-1220528
10.866648
11.165266
1.295206
other
Nd4V2Fe2O12
20
14
246.63
mp-1196790
7.667418
7.553759
-4.30131
other
U4Co2P4O44
54
14
893.55
mp-772440
13.582918
4.458961
-2.552712
other
Li8Mn4B20O40
72
14
797.15
mp-585241
9.719392
7.722812
-5.706169
other
Li4Bi8P12O48
72
14
1,068.83
mp-1211144
12.96211
5.478106
-0.483554
other
Li4Sm24B12O56
96
14
1,248.36
mp-1209260
13.619143
5.275872
-6.693879
other
Rb4Tb4P8O28
44
14
750.81
mp-758566
12.085617
7.650951
-7.515606
other
Li4Fe4P16O48
72
14
933.79
mp-1202286
8.249694
2.191058
-0.541179
other
Na4Sb8O8F24
44
14
771.06
mp-554263
13.282463
4.778638
-1.676219
other
Ca8B4Cl4O12
28
14
429.42
mp-653995
10.593365
7.762844
-2.457578
other
As16Pb32Cl24O44
116
14
2,723.05
mp-14691
13.267759
5.976933
-6.872875
other
Na4Er4P16O48
72
14
934.67
mp-1212755
8.479019
10.391699
1.552406
other
Gd4Zn2Pt2O12
20
14
238.13
mp-555164
13.351255
5.430624
-6.136407
other
Ca20P12Cl4O48
84
14
1,085.17
mp-1196390
8.316489
2.168738
-0.876015
other
Cu4Sb12Xe4F92
112
14
1,863.45
mp-1042595
7.719069
11.639896
-1.269223
other
Ti16Zn8Co8O56
88
14
1,076.28
mp-558330
7.206682
6.191681
-3.518266
other
I8Cl8O8F8
32
14
767.37
mp-770910
13.166344
5.60663
-2.948675
other
Li12Mn4B8O24
48
14
452.02
mp-21270
11.317188
7.764424
-1.647505
other
Li4Fe4Ge8O24
40
14
463.12
mp-558021
9.985993
8.481345
-3.46446
other
K8Mo4Se4O24
40
14
651.81
mp-1180274
11.279569
7.238646
-2.420897
other
Mn4Zn8Si4O24
40
14
475.97
mp-25995
12.943475
7.239999
-7.480753
other
Li16Co4P8O32
60
14
681.84
mp-26121
14.423885
7.262976
-7.106619
other
Li4Mn4P4O16
28
14
365.56
mp-1197337
10.012129
4.936527
-4.215261
other
Mo16H56N8O68
148
14
1,565.88
mp-14556
13.892943
4.252769
-2.259945
other
Sm4Cd4B20O40
68
14
669.35
mp-1044230
6.187736
9.589935
-1.77447
other
Mg4Co4Bi4O20
32
14
438.38
mp-554384
-2.465286
-0.508905
-5.314048
other
Na4Sb4P8S24
40
14
955.68
mp-1208092
8.681341
5.897749
-6.169621
other
Tm4Tl4S8O36
52
14
744.11
mp-1194672
10.964839
4.177109
-4.159323
other
Sr4Sn4H24O24
56
14
562.95
mp-758416
14.444758
8.369175
-4.270634
other
Li4P8W4O28
44
14
551.24
mp-1019785
9.659601
4.85958
-6.425555
other
K8Si4S24O84
120
14
1,664.68
mp-565593
9.477776
7.013316
-3.69001
other
Na12Nb4As8O36
60
14
1,066.19
mp-605863
-3.469486
-1.688595
-5.486209
other
Ag4Sb4Pb4S12
24
14
584.57
mp-758458
14.013062
8.024081
-6.764634
other
Li4V4P16O48
72
14
910.25
mp-24465
12.746544
6.149458
-6.227905
other
Ga4P12H8O40
64
14
757.52
mp-556709
14.399528
4.062905
-6.511144
other
Na16Zr8Si8O40
72
14
939.14
mp-1215013
8.381447
2.262168
-1.036645
other
Be4Co2N4F28
38
14
591.06
mp-558254
6.985793
3.015512
-2.818165
other
As4S16N16F20
56
14
1,011.74
mp-770786
11.516799
6.252542
-3.51296
other
Li12Ni4B8O24
48
14
430.63
mp-555727
13.147785
6.030535
-6.774669
other
Rb4Tb4P16O48
72
14
1,000.94
mp-543044
8.971171
0.978321
1.445565
other
Ba4Li4Al4F24
36
14
484.26
mp-1196912
-2.779282
-1.178917
-4.137969
other
Cu4P16Se12Cl4
36
14
936.91
mp-772431
9.119645
4.007222
-5.218625
other
Co2H16C4O20
42
14
424.99
mp-1047971
9.113756
0.594389
0.36518
other
Ba4Ca4Ni4F28
40
14
599
mp-849776
9.426957
3.497745
-5.294667
other
In8H80C24O88
200
14
2,042.95
mp-1044515
12.465179
8.093132
-1.036774
other
Zn4Sn4Ge8O24
40
14
557.6
mp-697850
13.990914
7.28362
-6.657927
other
Li8Cr4P16O48
76
14
904
mp-1196929
8.518661
1.57033
-0.483062
other
Cd4Bi4B4F40
52
14
759.58
mp-758769
8.001632
4.702668
-6.564419
other
Li4Ni4C8O24
40
14
516.81
mp-622619
10.654598
10.886205
-3.807684
other
U4V4Ag4O24
36
14
540.61
mp-649805
6.016596
3.484118
-4.755612
other
Fe16Ge4C64O64
148
14
2,334.42
mp-1268159
13.803452
7.760362
-0.903996
other
Li8Fe8Si12O36
64
14
849.15
mp-11913
7.608107
10.298088
1.119957
other
Na2Pr4Ir2O12
20
14
270.29
mp-559878
8.106248
9.869637
0.038641
other
K8Na8Ir4O16
36
14
598.83
mp-1188108
7.755068
10.552526
1.448036
other
Sr4Dy2Ru2O12
20
14
282.68
mp-1212186
6.167707
5.353657
-4.522074
other
K4Th4N20O68
96
14
1,410.81
mp-1379764
9.818549
11.42189
0.286763
other
Ca4V2Ir2O12
20
14
227.4
mp-667327
9.456943
7.526219
-1.863207
other
Ag8Pb32Cl16O28
84
14
1,932.79
mp-1212711
8.666001
10.305636
1.730592
other
Gd4Mg2Pt2O12
20
14
235.76
mp-849265
13.917366
7.135879
-5.982486
other
Li8Sb8P16O56
88
14
1,213.16
mp-1210865
7.31762
6.528104
-4.554689
other
Rb4Zn2S4O28
38
14
703.67
mp-1199625
6.331535
5.036334
-4.518792
other
Hg12H4N8O28
52
14
883.59
mp-555059
8.253923
2.332792
-0.947682
other
Tc4Sb4O8F32
48
14
785.96