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-758325
11.519261
7.407351
-2.326596
other
Li8Cu4Si4O16
32
14
342.29
mp-1176597
10.268801
4.698817
-7.044919
other
Li4V8S12O48
72
14
927.78
mp-758398
14.593495
7.972645
-5.244218
other
Li4Fe12P12O44
72
14
830.67
mp-1227487
9.673422
10.957727
0.942636
other
Ca4Mg2Re2O12
20
14
236.26
mp-540742
13.105607
6.112603
-6.526528
other
Nd4Tl4P16O48
72
14
1,040.31
mp-1365713
6.973052
12.469033
-1.856446
other
Mg8Mn16Co8O56
88
14
1,005.34
mp-766178
10.956932
4.319785
-4.035829
other
Sr4Sn2H16O16
38
14
411.97
mp-706631
13.596069
4.125058
-2.535145
other
Na16B24H8O48
96
14
1,000.03
mp-720874
10.993734
3.545831
-4.610405
other
P4H20N4O16
44
14
387.39
mp-1042777
11.805652
7.464836
-4.169074
other
Ca4Mn4As8O28
44
14
629.08
mp-697767
14.430353
8.484742
-5.097311
other
Li4Mo4P8O28
44
14
557.58
mp-1197845
7.858689
7.171986
-4.168972
other
Sr4U8I8O52
72
14
1,186.5
mp-753598
8.988023
3.412062
-7.760353
other
Li4V2C4O12
22
14
261.72
mp-1221256
9.540439
6.971975
-2.795477
other
Na10Y4Si12O48
74
14
1,082.28
mp-1042722
11.41083
7.681077
-4.463716
other
Mg4Co4As8O28
44
14
561.34
mp-1350669
11.053326
7.847882
-4.266369
other
Zn6Cu6As8O32
52
14
649.54
mp-758837
14.032754
7.17844
-5.6857
other
Li4Cu4P8O24
40
14
510.19
mp-554506
13.157864
5.542752
-6.723168
other
K12In12P16O64
104
14
1,579.6
mp-553877
12.83686
8.876831
-5.48683
other
Cd4Mo4P4O24
36
14
484.49
mp-759406
14.102941
7.340144
-6.190192
other
Li12Sb4P8O32
56
14
625.37
mp-505701
11.990273
4.87632
-5.118311
other
Na4P8H20O32
64
14
714.15
mp-757666
13.54667
4.409907
-2.51862
other
Ca4B20H12O40
76
14
760.71
mp-1212918
8.342484
2.837291
-4.806746
other
H28C16N36O24
104
14
1,142.52
mp-733973
8.69894
5.275634
-4.30564
other
Na4H20S8O36
68
14
962.93
mp-1105283
8.288486
10.610361
1.241476
other
Sr4In2Os2O12
20
14
272.71
mp-19475
13.857974
4.386556
-2.36494
other
La4Co4B20O40
68
14
651.88
mp-1047902
9.167219
1.996237
1.400188
other
Ba4Zn4Mo4F28
40
14
587.07
mp-1200277
7.09073
7.33143
-3.747856
other
Cs4Mg2Se4O28
38
14
799.2
mp-10288
-5.697205
-3.582664
-2.401008
other
La4Cu4Te4S4
16
14
378.74
mp-1196626
12.883471
7.418854
-6.916307
other
Sr2Co6P8O28
44
14
526.46
mp-504264
12.074121
7.25013
-7.15231
other
Li4Cu4P4O16
28
14
289.08
mp-705909
11.649008
4.475788
-4.719311
other
Be8P4H20O28
60
14
621.01
mp-26717
11.445684
7.701561
-7.590582
other
Li4Fe4P8O28
44
14
484.5
mp-1204149
-4.062422
-2.378997
-4.083821
other
K16Ge8Se24O12
60
14
1,840.09
mp-561473
10.936872
10.574443
2.992344
other
Ca4Ta4Al4O20
32
14
399.05
mp-1203622
10.657542
10.783282
-2.524076
other
Li8Te4Mo4O24
40
14
512.69
mp-1202110
8.376658
2.474449
-5.148785
other
Zn12H48C36O52
148
14
1,822.16
mp-1181790
10.227115
4.856356
-4.368032
other
Co4H16Se4O20
44
14
449.5
mp-758633
8.569486
3.829401
-7.217057
other
Li4Fe8C8O28
48
14
682.49
mp-1044295
6.131193
9.789744
-1.73764
other
Zn4Co4Bi4O20
32
14
444.1
mp-1043428
14.648112
8.533356
-4.099723
other
Mg2V6P8O28
44
14
512.01
mp-1201465
8.306002
3.281319
-4.763251
other
H32C8N32O24
96
14
993.52
mp-1198786
10.197211
10.737524
-3.852759
other
Rb8U4Mo8O44
64
14
1,251.4
mp-571621
4.669199
1.927987
-2.46262
other
Ba12Na8C16N32
68
14
1,094.95
mp-1196732
7.588221
6.574629
-3.115798
other
Rb12H24I36O108
180
14
2,885.29
mp-581887
8.168576
2.029767
-0.736595
other
Ca4As8Xe10F68
90
14
1,573.78
mp-560110
10.971778
9.461938
1.844577
other
Ba4U4Ti4O24
36
14
574.87
mp-1188959
9.80824
9.712619
3.685998
other
Sr4Lu2Nb2O12
20
14
283.78
mp-758814
8.691795
2.077036
-1.328384
other
Ca4As8H24F72
108
14
1,366.19
mp-12878
9.335117
9.170154
2.323106
other
Sr4Y2Sb2O12
20
14
290.06
mp-1335345
6.277744
11.859779
-1.736581
other
Mg8Co8Ni16O56
88
14
949.13
mp-1048332
14.480691
7.594997
-5.88243
other
Zn4Cr4P8O28
44
14
527.63
mp-1044891
12.505084
7.919553
-0.925683
other
Mg4Mn4Ge8O24
40
14
492.79
mp-6565
14.203976
5.116667
-7.123967
other
Li12Sc8P12O48
80
14
991.45
mp-695987
10.247142
3.604059
-4.649803
other
Mg4H40C4O32
80
14
693.99
mp-780333
12.814062
6.418747
-6.285707
other
Li12Bi8P12O48
80
14
1,130.28
mp-707285
9.662384
4.74451
-4.193681
other
Cu2H32I4O32
70
14
649.87
mp-1201336
7.256592
7.323518
-3.928787
other
Rb4Ce4Se8O52
68
14
1,222.61
mp-648633
6.051638
3.520406
-4.718383
other
Fe12C40S4O40
96
14
1,533
mp-1042817
11.256115
7.768359
-4.441055
other
Mg4Ni4As8O28
44
14
554.58
mp-1195843
10.721249
4.280858
-4.648476
other
Fe4H32S4O32
72
14
667.13
mp-1207884
11.92364
7.666593
-7.309661
other
Zn16Fe16P16O80
128
14
1,445.38
mp-1041706
12.081553
7.865025
-3.997707
other
Zn6Fe6As8O32
52
14
690.56
mp-572790
13.498173
6.463461
-6.558009
other
Cs8Mn4P16O48
76
14
1,253.71
mp-1199227
5.827107
3.526909
-4.074821
other
S24N24Cl24O16
88
14
1,913.69
mp-1213068
-5.432707
-2.400042
-2.819831
other
Cu4Te4Se4I4
16
14
488.02
mp-559115
8.516489
2.244328
-1.116633
other
P16Rh8Cl8F48
80
14
1,512.98
mp-558011
10.352646
4.166572
-6.076499
other
Cd8H8S4O24
44
14
517.59
mp-818373
10.606583
8.877395
-6.918491
other
Rb4V4P8O32
48
14
657.35
mp-774616
7.746701
2.133385
-4.413253
other
H20C12N20O4
56
14
554.07
mp-727071
-3.418919
-0.044471
-3.51687
other
Re12Te16C12N12
52
14
2,319.35
mp-765153
8.265616
3.944789
-7.316745
other
Li20Fe4C16O48
88
14
901.49
mp-561138
13.121823
6.06841
-6.713651
other
Rb4Gd4P16O48
72
14
1,015.5
mp-818535
9.676443
9.773325
-3.791122
other
Rb8Te4Mo12O60
84
14
1,676.52
mp-1203023
5.376129
-0.502842
-3.018359
other
Na4Zn8B20H80
112
14
1,406.38
mp-1220540
6.95393
11.227909
1.097664
original
Nd4Fe2Ni2O12
20
14
238.95
mp-1195946
8.788398
7.688258
-3.634266
other
Cu28Se8Cl24O32
92
14
1,576.9
mp-554998
7.719654
7.20948
-3.447383
other
Li4V4I8O32
48
14
654.1
mp-1203505
7.235902
5.356317
-4.837963
other
Ca4C8Cl4O28
44
14
622.45
mp-1219893
8.233842
10.852331
1.761178
other
Pr4Mn2Rh2O12
20
14
253.37
mp-1247745
7.107156
11.481753
1.200592
other
Lu4Fe2Co2O12
20
14
216.54
mp-757937
9.116392
7.060065
-3.698401
other
Cr4H4Se12O32
52
14
752.91
mp-705361
12.615063
7.912038
-7.750177
other
Li4Cr4P8O28
44
14
549.82
mp-1044206
14.675589
8.527763
-4.201979
other
V6Zn2P8O28
44
14
513.89
mp-1044272
11.847515
10.928761
-2.025819
other
Mg4Bi4Mo4O20
32
14
496.66
mp-1204086
9.010333
8.133747
-5.383119
other
K4V8P12O60
84
14
1,172.25
mp-1200138
7.781126
2.767015
-2.517213
other
Pt2C16S8F24
50
14
788.24
mp-1209471
13.687675
5.245525
-6.663604
other
Rb4Ho4P8O28
44
14
738.12
mp-1043139
11.73085
7.640995
-1.220596
other
Ca4Ni4Ge8O24
40
14
484.76
mp-560128
8.940908
5.610944
-5.944792
other
Eu4H4S4O20
32
14
356.09
mp-1211799
8.677938
5.873078
-6.182455
other
Lu4Tl4S8O36
52
14
732.52
mp-26785
10.0268
8.159838
-6.542585
other
Li4Ni4P8O28
44
14
470.04
mp-1202387
6.437268
5.321193
-4.351699
other
Co4P4N20O24
52
14
851.76
mp-1205044
2.709443
2.314735
1.77983
other
Gd8Si16C4N24
52
14
627.91
mp-758019
14.421851
8.384402
-4.141055
other
Li4P8W4O28
44
14
564.91
mp-758883
12.102172
7.585464
-7.493984
other
Li4Fe4P16O48
72
14
924.46
mp-1192472
11.719169
7.235465
-6.060003
other
Cu4Ag4P4O16
28
14
340.9
mp-1198579
10.413363
4.294379
-5.988219
other
Nd4H12S8O36
60
14
676.01
mp-1196334
11.761885
7.369857
-3.962195
other
Ba16U8As16O80
120
14
2,126.06
mp-24460
10.218176
4.689973
-5.69945
other
Mg2H12S8O32
54
14
646.75