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-758446
8.74738
3.83526
-7.554505
other
Li4V8C8O32
52
14
560.62
mp-1201498
9.22182
2.745493
-4.610424
other
H64S4N24O40
132
14
1,183.43
mp-1369121
9.144552
12.170032
-0.26729
other
Ti2Zn4Ir2O12
20
14
209.31
mp-7827
4.15392
2.243098
-3.224272
other
K4Ni2C8N8
22
14
451.82
mp-1296431
12.117777
10.949184
0.3325
other
Ca4V2W2O12
20
14
245.83
mp-728246
9.440617
7.401159
-2.958711
other
U4Si4Pb4O28
40
14
612.18
mp-1204142
8.659709
8.862489
-4.375469
other
U4V4N4O24
36
14
619.49
mp-1048266
14.586975
7.511204
-5.953116
other
Mg4Cr4P8O28
44
14
526.02
mp-1256602
10.048387
2.401274
-2.96215
other
Si2H28O8F12
50
14
473.96
mp-679948
5.600209
3.24843
-4.760435
other
Os24C64S16O64
168
14
3,041.12
mp-556172
9.935583
7.096797
-1.872039
other
Si4Pb16Br16O16
52
14
1,300.15
mp-1180193
8.639275
6.202139
-5.20836
other
Ni2P12N8O44
66
14
1,126.83
mp-557252
9.901449
4.686695
-6.999499
other
K16V12S20O92
140
14
2,050.53
mp-1189894
7.483691
11.784515
1.845985
other
Y4Mn2Co2O12
20
14
217.66
mp-23831
10.783289
4.041055
-6.510445
other
Nd4H4S4O20
32
14
365.18
mp-1019543
13.194074
5.611164
-6.268508
other
Ba8Ca8P16O56
88
14
1,221.43
mp-765226
12.057369
7.484805
-7.404396
other
Li12Ni12P12O48
84
14
995.75
mp-1208889
9.947664
9.738622
3.637874
other
Sr4Dy2Ta2O12
20
14
289.52
mp-557272
3.76203
2.767823
-3.833075
other
Al4S8N8Cl16
36
14
926.94
mp-1198581
10.590866
8.47882
-4.96623
other
Cs8V20H20O64
112
14
1,667
mp-26046
10.139544
8.178623
-6.551928
other
Li4Cr8P12O48
72
14
849.25
mp-559818
9.416995
6.868423
-3.436465
other
Sr4Mn4Se8O24
40
14
663.22
mp-24776
8.668991
4.133937
-4.411253
other
Fe4H72N12O72
160
14
1,490.37
mp-1216171
7.968205
11.63874
1.826656
other
Y4Mn2Fe2O12
20
14
235.41
mp-774742
14.224584
5.131558
-7.141326
other
Li12Sc8P12O48
80
14
992.08
mp-757658
14.179004
7.356547
-6.127786
other
Li4Ti4P16O48
72
14
910.67
mp-561012
12.407812
6.524882
-6.711874
other
Sr6Cu6P8O32
52
14
712.46
mp-18744
10.704444
10.695976
1.61099
other
Sr4Er2Mo2O12
20
14
284.61
mp-604295
8.69176
1.198778
-4.206705
other
Hg2H32Br12N8
54
14
777.09
mp-18436
14.483166
8.125972
-6.496152
other
Rb4V4P8O28
44
14
632.98
mp-1047859
9.165434
1.050452
1.209336
other
Ba4Mg4Cr4F28
40
14
543.97
mp-557679
12.849482
6.155333
-0.621931
other
K12Na12Si24O60
108
14
1,646.45
mp-553963
7.93958
7.277738
-4.312925
other
Yb4Se4O12F4
24
14
341.28
mp-1195248
11.714773
7.589807
-4.357308
other
Cs4Cr4As8O28
44
14
671.18
mp-1209322
9.000641
6.690725
-3.86546
other
Rb4Sm4Se8O32
48
14
774.63
mp-1212655
7.72679
11.584394
1.724777
other
Gd4Mn2Ni2O12
20
14
230.47
mp-1041248
8.433913
1.387753
1.362758
other
Ba4Mg4Bi4F28
40
14
611.21
mp-696656
10.182939
2.288201
-2.934799
other
B4H16O8F12
40
14
368.06
mp-698025
12.921168
5.882515
-1.163899
other
Na8Si12H8O32
60
14
768.64
mp-740752
10.031269
4.985401
-3.991029
other
Ba4Re8H32O48
92
14
1,184.64
mp-26241
14.77914
8.502849
-4.150236
other
Li4V6P8O28
46
14
532.44
mp-1195388
8.934476
0.595051
0.643892
other
Cs4Ti2Cu6F24
36
14
600.28
mp-761188
8.992015
11.376557
-3.951316
other
Li4V12Co8O48
72
14
923.36
mp-1041724
11.990502
10.846224
-2.199832
other
Zn6As8W6O32
52
14
804.07
mp-700033
11.346653
9.415885
-0.152791
other
Na24U20V8O92
144
14
2,197.7
mp-643934
8.318343
3.24712
-5.79556
other
Cu2H4C4O8
18
14
401.15
mp-555591
8.972468
0.97573
1.404699
other
Sr4Li4Al4F24
36
14
450.35
mp-24708
10.419494
4.015471
-4.58327
other
Zn4H32S4O32
72
14
660.24
mp-1193256
7.503765
3.923137
-5.590801
other
Na4C8N4O12
28
14
416.17
mp-1047810
6.578011
11.190454
-1.330575
other
Ca4Cu8Ni8O32
52
14
657.56
mp-757899
13.875991
6.831047
-6.210176
other
Li12Sn8P12O48
80
14
1,071.7
mp-504605
10.8317
3.721393
-4.10149
other
Na8Si4H64O44
120
14
1,059.96
mp-1198169
8.501696
2.111676
-0.779443
other
K8Mo4O12F16
40
14
724.51
mp-1203886
8.011133
4.975964
-6.006934
other
Na8Np4C8O32
52
14
769.02
mp-762358
10.431902
4.121987
-5.143255
other
La4H36S8O48
96
14
1,002.33
mp-725073
10.15917
3.125854
-3.917045
other
Fe2H16Cl4O8
30
14
356.17
mp-1367958
12.306358
10.503015
1.351728
other
Ca4Ta2W2O12
20
14
256.17
mp-1197781
7.829518
7.126258
-4.099543
other
Ba4U8I8O52
72
14
1,243.09
mp-540737
11.855742
5.263631
-5.238858
other
Zr4P8H16O36
64
14
781.89
mp-583853
14.799784
7.80771
-5.549477
other
Li4Cr4P4O16
28
14
356.91
mp-1214975
6.077638
5.030797
-4.409913
other
Ag6C4N4O12
26
14
396.93
mp-19482
13.821095
8.041272
-7.036783
other
Na8V4P8O32
52
14
669.49
mp-1212192
7.245255
7.619573
-3.827854
other
K4Co2S4O28
38
14
602.06
mp-696936
9.630252
4.936893
-6.101333
other
Fe6H8S8O36
58
14
644.89
mp-1208508
6.175058
5.762139
-4.446931
other
Th2Ni2N12O52
68
14
965.11
mp-1225428
11.03103
11.087267
1.256881
other
Dy4V2Fe2O12
20
14
225.53
mp-25938
12.03496
8.81143
-6.339981
other
Li4Mo4P8O32
48
14
611.96
mp-1219251
9.52596
10.464743
3.040762
other
Sm4Ti2Cu2O12
20
14
240.69
mp-1252808
6.29845
0.02522
-3.325974
other
Al8B24H112N8
152
14
1,499.75
mp-1201255
7.465979
6.967574
-4.466622
other
U4Ni2P4O44
54
14
918.8
mp-849421
12.162892
9.308277
-7.588698
other
Li4V8P12O48
72
14
887.51
mp-1201190
9.543611
1.67277
-3.975854
other
Ga4H36N12F12
64
14
536.24
mp-559070
12.621926
6.851721
-6.978826
other
Li8Hg4P16O48
76
14
958.17
mp-1191464
10.086856
9.165051
-1.410626
other
U2Te2Pb4O16
24
14
372.69
mp-1208756
9.845713
9.737288
3.651801
other
Sr4Tb2Ta2O12
20
14
290.55
mp-761898
7.917048
0.381609
-4.521481
other
Sb12H72C24N4
112
14
1,442.01
mp-1214166
13.686955
8.791985
-7.287717
other
Ca4V8P12O48
72
14
849.74
mp-1019717
9.973611
4.626791
-6.4874
other
Cs4B4S12O44
64
14
1,040.59
mp-705007
14.125368
7.866377
-5.830066
other
Li4Mo4P16O48
72
14
967.78
mp-560260
10.481497
4.204812
-7.159669
other
Cs4La4S8O32
48
14
785.43
mp-559941
10.856658
11.968669
-3.36556
other
Ba8V12Bi4O44
68
14
1,107.98
mp-1338846
10.388021
12.194355
-3.81944
other
V16Zn8Co8O56
88
14
1,090.33
mp-1208810
7.879446
9.708293
-0.443215
other
Sr4Li2Te2O12
20
14
266.69
mp-729390
3.416501
2.508316
-3.527825
other
Cu16C24Br40N8
88
14
2,832.91
mp-1199374
9.532368
1.79199
-3.541489
other
Ta4H36N12F20
72
14
696.24
mp-1214687
7.304917
6.923144
-4.349267
other
Co2S4N4O28
38
14
596.61
mp-758508
8.14102
4.123746
-6.933393
other
Li4Fe4C8O24
40
14
562.23
mp-6362
7.33398
10.48489
1.102494
other
Sr4Tb2Ir2O12
20
14
284.55
mp-861113
8.921225
4.645223
-4.076491
other
Ni2H32Cl4O32
70
14
738.01
mp-1203507
11.255063
4.419359
-4.773722
other
Cu4P4H20O20
48
14
451.66
mp-1212607
8.200994
2.277918
-4.686962
other
H16C4N24O8
52
14
606.11
mp-555489
13.13711
5.162025
-0.721541
other
Li4Y24B12O56
96
14
1,173.35
mp-572543
13.043102
5.990193
-6.674725
other
Cs4Pr4P16O48
72
14
1,025.6
mp-772591
13.675059
7.573555
-0.861062
other
Li8Mn8Si8O28
52
14
636.29
mp-559937
10.291736
9.344142
-1.89924
other
U4Te12Pb8O44
68
14
1,141.14
mp-1347506
7.336783
11.542745
-0.844027
other
Mg4Cu2Ir2O12
20
14
207.63
mp-541636
13.169456
6.052135
-6.782342
other
K4Er4P16O48
72
14
972.12
mp-1181495
7.772596
4.74737
-5.763906
other
K4U4C12O40
60
14
972.97
mp-1201529
11.549892
7.206294
-3.054839
other
V4B4Pb16O32
56
14
928.82
mp-850709
12.159159
7.485683
-7.408232
other
Li8Ni8P8O32
56
14
659.67