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-1204349
5.738987
5.314142
-4.153931
other
Cd8Cl16O20
44
14
1,308.55
mp-1198555
7.145604
5.24136
-4.714974
other
U4C8O36
48
14
897.39
mp-1048396
9.366442
7.899767
-5.870663
other
Fe4P8O28
40
14
559.4
mp-777787
11.89877
7.13992
-4.126875
other
Ho4As4O16
24
14
303.12
mp-23423
10.969663
10.010647
-2.490508
other
Bi32Mo16O96
144
14
2,260.71
mp-1337197
10.438629
0.0982
0.492285
other
Mg4Mn4F20
28
14
358.72
mp-726839
8.48248
7.12653
-3.917533
other
In4Se8O24
36
14
612.1
mp-772022
-1.194502
1.96271
-1.761977
other
Sr8La4I28
40
14
1,662.4
mp-29290
7.685243
2.507251
-1.386939
other
W4N12F20
36
14
606.37
mp-1196150
7.955209
9.086968
-3.707097
other
Ba4Re8O48
60
14
1,107.46
mp-17504
-4.791972
-5.067151
0.409458
other
Sr12Ge8As16
36
14
994.5
mp-1328934
9.546951
1.168779
0.721061
other
Zn4Cr4F20
28
14
360.2
mp-18068
10.023745
8.970906
-2.322577
other
Ag8Te4O12
24
14
390.35
mp-569348
-0.35838
1.204963
-4.304555
other
Tl8Ga8Br32
48
14
1,675.05
mp-1208108
10.869386
8.188116
2.442982
other
Tm16Al8O36
60
14
798.82
mp-559349
8.348559
2.394701
-0.964643
other
Sb8Cl4F68
80
14
1,256.11
mp-768893
10.202723
9.552936
-1.892225
other
Mg8Te12O36
56
14
691.38
mp-1214746
1.105451
1.583761
-5.076559
other
Ba8Dy4Cl28
40
14
1,135.32
mp-29223
12.805231
6.241469
-0.521629
other
Ba12Si20O52
84
14
1,360.99
mp-1195483
-2.869888
-2.49516
-5.061077
other
Ba4Th8S20
32
14
813.59
mp-10970
9.855233
8.781067
3.273508
other
Li4Er4O8
16
14
198.5
mp-1048407
14.048989
8.634664
-5.068619
other
P8W4O28
40
14
587.91
mp-27383
11.108338
11.86795
2.355387
other
Nb12Cu4O32
48
14
581.16
mp-28588
11.997872
6.628655
-1.249427
other
Na16Be8O16
40
14
462.93
mp-27911
11.168255
7.699043
-3.420795
other
Bi4As4O16
24
14
321.68
mp-1197740
-3.052142
-2.324304
-5.48943
other
Ce8Si4S20
32
14
734.34
mp-570942
-0.394631
0.718105
-2.525455
other
La12C12Cl8
32
14
683.44
mp-1042545
6.220359
12.289145
-1.870542
other
Ca8Co24O56
88
14
1,031.54
mp-1195429
10.015704
10.459669
-3.961025
other
Th4Mo8O36
48
14
775.19
mp-643905
8.246046
1.042812
-3.880138
other
Sr4H16N8
28
14
325.74
mp-828605
8.039745
9.890152
-0.186358
other
Rb16Fe4O16
36
14
731.77
mp-17569
8.416483
1.701989
-0.097359
other
Sm4Pt4F28
36
14
525.88
mp-866711
2.09298
2.841141
-4.390261
other
Fe4S4Cl28
36
14
1,041.45
mp-673020
10.523679
7.528458
-6.453661
other
Bi4P16O48
68
14
971.76
mp-531036
-3.127491
-1.338572
-5.067199
other
Ba16Nb14S48
78
14
1,924.76
mp-1201084
7.337005
7.901636
-3.50585
other
Ba8B16O64
88
14
1,338.15
mp-753390
10.061708
1.954798
1.728758
other
Li6V2F12
20
14
210.78
mp-1181440
8.920699
6.154746
-3.736862
other
Mg4B24O64
92
14
1,267.07
mp-778715
10.497652
0.985671
1.640273
other
Li8Mn16F40
64
14
807.87
mp-861175
10.105097
1.860686
0.63786
other
Li8V4F24
36
14
381.48
mp-5401
13.503878
4.634675
-1.59417
other
Sr8B8O20
36
14
492.47
mp-1238093
8.503311
7.889696
-4.093006
other
Hg4As4O16
24
14
422.55
mp-1272755
11.375166
12.087393
0.271861
other
Li8Fe4O8
20
14
184.56
mp-1212636
9.943311
10.664467
-3.84968
other
Gd4Mo4O20
28
14
430.74
mp-1183023
7.099277
6.08738
-4.228442
other
Al4S4O40
48
14
713.38
mp-26854
10.353982
8.15649
-6.763721
other
Cr4P8O28
40
14
474.12
mp-26124
10.732315
9.37381
-7.092556
other
V8P12O48
68
14
868.83
mp-697814
9.135673
7.807787
-5.753648
other
Co4P8O28
40
14
577.15
mp-1212176
8.679466
1.481158
1.357429
other
Hf4Tl4F20
28
14
408.82
mp-1181883
7.588938
9.318066
-1.207877
other
Ca4Ti8O24
36
14
469.92
mp-1195011
11.307837
8.830248
0.938566
other
Na8U8O28
44
14
671.46
mp-18165
-3.655982
-1.597199
-5.691614
other
Na12Ga4S12
28
14
623.04
mp-8412
11.412023
9.027456
2.387913
other
Li4Ce4O8
16
14
201.82
mp-558469
-2.684281
-0.490866
-5.43412
other
Ag24P12S36
72
14
1,583.78
mp-1209230
8.206991
2.545296
-1.068578
other
Sc2N6F12
20
14
310.5
mp-1208109
7.300303
6.752331
-3.863961
other
V4I4O28
36
14
606.42
mp-753311
12.31625
11.978146
0.295745
other
Cr6O4F4
14
14
194.55
mp-766310
-1.204006
1.92626
-1.757962
other
Ba4Ca8I24
36
14
1,609.9
mp-1193738
6.324427
5.711946
-4.255361
other
Mg2N4O24
30
14
446.41
mp-510367
14.419045
8.010742
-5.13773
other
Fe4P4O14
22
14
240.05
mp-754355
11.24866
4.29003
-3.29405
other
Tm4H12O12
28
14
336.48
mp-5125
-4.934719
-2.677572
-3.722663
other
Na12Fe4Se12
28
14
678.94
mp-759543
13.177395
0.591878
0.674058
other
Fe4O4F4
12
14
131.29
mp-17213
9.344848
8.388547
-0.134948
other
Cs16Sn4O16
36
14
946.74
mp-706625
9.681711
4.809621
-4.253413
other
Te4H20O24
48
14
507.2
mp-1209319
8.666121
7.692926
-5.060311
other
Sn4P8O36
48
14
673.82
mp-752419
-1.19364
2.033541
-1.90706
other
Sr4Ca4I16
24
14
1,014.6
mp-770271
1.048541
1.716382
-5.228235
other
Ba4La4Cl20
28
14
1,110.6
mp-579637
-5.209653
-5.99017
0.445755
other
K16In16Sb24
56
14
2,000.82
mp-18183
8.646324
1.445248
0.819016
other
Y4Sn4F28
36
14
522.09
mp-1196187
7.948383
5.406276
-5.918768
other
Cu8C4O20
32
14
339.02
mp-554767
10.274644
12.408682
-3.634893
other
Mg8V8O28
44
14
541.52
mp-1195337
-0.762962
1.253747
-4.177797
other
Ir4Se12Br36
52
14
1,681.79
mp-770541
12.407493
7.977002
-7.903733
other
Mn8P4O20
32
14
351.65
mp-542448
-4.704892
-3.020981
-3.718019
other
Cs12Ga4Se12
28
14
1,083.79
mp-3856
12.922433
10.404714
0.015904
other
Ca4Mo20O32
56
14
816.22
mp-1178430
9.110477
8.490998
0.145933
other
Cs12Er4O12
28
14
741.3
mp-27866
1.426207
2.864993
-4.629987
other
Mo4S8Cl12
24
14
570.07
mp-1192372
8.558551
7.672614
-4.681736
other
Hg4P4O16
24
14
462.8
mp-756544
9.597099
8.686676
2.754097
other
Li4La4O8
16
14
244.87
mp-1197251
6.899889
7.456832
-3.495298
other
Mg2I4O32
38
14
545.39
mp-1047477
11.463796
7.845412
-4.19743
other
Ti6As8O32
46
14
684.84
mp-1180351
7.169214
6.445422
-4.062974
other
Mo4N8O16
28
14
557.65
mp-18157
13.052291
6.233644
-6.683816
other
Si4P8O28
40
14
433.71
mp-556914
11.638903
11.204105
-2.728416
other
P4W10O38
52
14
757.2
mp-540146
10.565731
8.1207
-7.51283
other
Mn4P4O16
24
14
343.31
mp-723419
-0.393665
0.256263
-4.430994
other
Sb8S76F48
132
14
3,112.24
mp-771963
1.108417
1.685142
-5.22213
other
Ba8La4Cl28
40
14
1,301.44
mp-1207562
7.525613
6.545801
-4.511217
other
Zn2P4O20
26
14
383.94
mp-1209417
9.860597
10.837301
-3.201831
other
Pr4W4O20
28
14
469.94
mp-1209199
8.160294
6.368888
-5.297572
other
Rb4S4O16
24
14
447.54
mp-25868
11.059583
8.6727
-5.91924
other
Mo4P8O32
44
14
700.18
mp-757302
12.967543
8.64411
-5.907825
other
P12W8O52
72
14
1,174.63
mp-1198129
7.795023
10.295009
1.693311
other
Nd12Ir4O28
44
14
615.32
mp-560623
13.48687
5.648626
-6.301684
other
Mg6P4O16
26
14
283.74
mp-1182953
8.13233
3.961827
-6.261584
other
Ag4C4O8
16
14
215.71
mp-849226
10.184278
0.47977
0.104063
other
Li4Fe4F16
24
14
254.2
mp-568762
-4.627262
-2.992922
-3.777884
other
Na32Ge16Se40
88
14
2,328.05
mp-770284
10.499892
10.573283
3.360086
other
Sm4Ta4O16
24
14
310.24
mp-1200101
13.406984
5.87333
-6.895102
other
Er12P36O108
156
14
2,344.24