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-1204124
6.187211
5.565501
-4.445776
other
Lu4N12O52
68
14
1,013.45
mp-1229167
-3.141563
-1.121283
-4.70804
other
As8Se4S8
20
14
532.58
mp-1179031
8.486417
1.213869
1.085741
other
Yb4Be4F16
24
14
409.42
mp-1220014
9.605255
11.026236
-1.829383
other
Ni4Te4O16
24
14
261.63
mp-555414
-5.068252
-5.997412
0.696319
other
Ba12Sb16O4
32
14
1,121.39
mp-31005
12.891857
5.927987
-6.250659
other
Zn6P4O16
26
14
318.64
mp-863432
7.530766
6.570604
-3.168259
other
Co4I8O24
36
14
537.26
mp-1188358
5.310794
5.027345
-4.205422
other
Sn4Cl8O8
20
14
576.51
mp-28393
-3.000183
-1.40107
-3.820915
other
P12Se16I4
32
14
1,009.19
mp-756852
10.427122
10.569388
3.321097
other
Tb4Nb4O16
24
14
311.21
mp-1221319
-4.930892
-5.691412
0.358623
other
Na8Sb4As4
16
14
441.5
mp-1200429
8.14176
6.717508
-4.70296
other
Mg8C4O20
32
14
366.93
mp-766365
-1.223287
1.907112
-1.706397
other
Ba4Ca4I16
24
14
1,187.55
mp-559617
13.965118
4.377201
-2.174848
other
Hf4B8O20
32
14
269.88
mp-568644
-4.796941
-3.059469
-3.817118
other
K36In4Se28
68
14
2,342.3
mp-1247321
0.37364
2.487379
2.000034
other
Li4Fe8N8
20
14
175.97
mp-28465
10.592822
10.686048
-3.787039
other
Ba4Mo12O40
56
14
831.73
mp-769334
9.068582
6.649547
-3.965606
other
Eu4Se4O16
24
14
343.9
mp-662535
9.447272
7.212047
-3.374887
other
Pb4Se8O20
32
14
506.97
mp-554988
11.43692
7.473589
-1.459829
other
Ag24Ge24O60
108
14
1,437.47
mp-17065
11.810663
7.183094
0.79605
other
Ho8Si4O20
32
14
393.35
mp-27493
13.983383
7.208509
-5.14022
other
Sn12P8O32
52
14
881.7
mp-625928
7.495546
6.487046
-3.15951
other
H4I12O32
48
14
715.93
mp-1105804
7.661285
6.859591
-4.16698
other
Na2Se4O12
18
14
325.66
mp-1195877
6.479753
0.367406
-3.411335
other
B40H52Cl4
96
14
1,007.01
mp-1178219
10.690714
12.421226
0.46115
other
Hf4Ni4O12
20
14
216.25
mp-776715
10.152706
1.582269
2.020574
other
Li12Fe8F28
48
14
630.78
mp-28749
8.56626
1.902142
-0.862497
other
Cr4Xe4F24
32
14
541.85
mp-1180162
6.8265
7.134986
-3.760191
other
Ni2Cl4O12
18
14
322.47
mp-27556
11.15271
11.245239
2.682471
other
Cs8Nb8O24
40
14
769.58
mp-1196330
-0.594035
1.210614
-4.160388
other
Tc16Br26O4
46
14
1,420.68
mp-1176505
12.19476
6.232619
-0.364308
other
Lu4H4O8
16
14
168.65
mp-1203769
4.983169
3.168141
-3.497305
other
Cs4Co6N48
58
14
951.57
mp-27618
10.135687
8.680317
0.223628
other
Na32Ga8O28
68
14
888.4
mp-764046
14.985544
12.441431
-0.885353
other
V6O8F4
18
14
188.84
mp-772175
14.105948
7.305047
-6.078056
other
Cr4P16O44
64
14
911.84
mp-29718
-1.600975
2.594352
-4.928355
other
Ag4W12Br28
44
14
1,300.16
mp-1211540
1.163424
1.86879
-5.270252
other
K4Y8Cl28
40
14
1,117.89
mp-1246831
0.401306
2.507978
1.917672
other
Mn40Co4N36
80
14
800.24
mp-1198177
13.53782
6.861365
-5.748987
other
Sn8P4O20
32
14
511.19
mp-24381
10.286197
3.087548
-3.928098
other
H20Cl4O8
32
14
310.02
mp-26302
9.110182
7.814037
-5.140341
other
Bi8P12O48
68
14
1,057.31
mp-10620
9.56371
8.734314
3.164262
other
Li4Pr4O8
16
14
202.2
mp-818295
12.085139
7.657847
-2.006147
other
Fe36Si24O100
160
14
1,871.06
mp-2969
-4.54767
-2.973464
-3.57385
other
Cs4Sb4Se8
16
14
591.16
mp-30979
-2.274132
-0.409379
-5.387786
other
Ga4P4S16
24
14
586.37
mp-1207669
8.733245
1.963392
2.420435
other
Tm4O4F4
12
14
159.44
mp-1196930
8.187364
1.433863
-0.381263
other
Bi4Xe4F28
36
14
637.87
mp-775276
8.791403
7.347904
-3.844247
other
Co6Se8O24
38
14
505.87
mp-1209482
9.987519
10.655195
-3.86509
other
Pr4Mo4O20
28
14
466.28
mp-773199
7.745679
9.806185
-0.476327
other
Cs12Co4O14
30
14
702.78
mp-648448
8.481052
8.318872
-1.099465
other
Eu8Ge4O20
32
14
442.63
mp-1203869
7.406449
10.849734
1.717987
other
La16Co12O40
68
14
863.65
mp-1195558
8.492599
1.471659
-4.07772
other
Zn2H60N32
94
14
928.38
mp-755644
14.038186
7.61972
-6.972863
other
Mn4P4O14
22
14
249.02
mp-776172
7.782176
10.132524
-1.95076
other
Al4Cu4O12
20
14
198.43
mp-31229
-4.342715
-1.954849
-3.12493
other
Na16B36Se36
88
14
1,838.52
mp-3831
13.510886
5.227858
-6.388924
other
Sm4P4O16
24
14
284.39
mp-764887
12.604157
7.828478
-6.548195
other
Co36P24O96
156
14
1,785.82
mp-557351
13.916737
4.20053
-2.422909
other
Bi4B12O24
40
14
362.18
mp-16795
8.96448
0.991836
1.422514
other
Ca4Al4F20
28
14
360.3
mp-1181395
7.950074
5.934685
-5.152618
other
La8S12O64
84
14
1,324.3
mp-26552
9.84094
8.221903
-6.608694
other
Co10P12O44
66
14
845.82
mp-18130
12.308795
6.665255
0.345937
other
Nd8Si8O28
44
14
563.32
mp-777618
7.101812
10.65523
-0.891114
other
Na32Co16O40
88
14
1,205.13
mp-556633
9.348508
1.82496
1.541666
other
Na6V2F12
20
14
264.86
mp-1199547
9.584886
6.119366
-3.762218
other
Tl4B20O48
72
14
1,027.88
mp-505750
-4.614814
-2.905696
-3.764226
other
Rb8Sn16Se32
56
14
2,029.4
mp-28701
-2.880931
-0.792272
-5.199021
other
Cs4Sb4S24
32
14
974.58
mp-31004
8.644074
4.566515
-4.991262
other
Sn4S8O16
28
14
558.59
mp-1195169
7.762291
7.26445
-3.922961
other
Zn6Se8O28
42
14
641.05
mp-20564
10.779616
11.406598
-2.897184
other
V4Pb6O16
26
14
403.03
mp-1200154
9.124794
6.496025
-5.663878
other
P8Pb4O32
44
14
699.68
mp-779413
13.231294
6.382044
-6.2802
other
Ba4P16O44
64
14
1,161.35
mp-18566
8.534654
1.326571
1.006914
other
La4Sn4F28
36
14
588.16
mp-7624
12.340405
6.600612
0.228752
other
Er4Si4O14
22
14
276.47
mp-1029838
0.949072
2.245353
1.921561
other
Sr4Cr4N8
16
14
234.48
mp-28271
8.8505
1.966565
1.102268
other
Sn20B4F52
76
14
1,379.4
mp-559203
9.401115
7.031748
-3.277714
other
Cd8Se8O24
40
14
632.49
mp-28428
-4.512777
-2.076441
-3.27782
other
K12Nb8Se44
64
14
1,967.8
mp-7534
9.072615
8.707196
0.384861
other
K4Cd4O6
14
14
257.01
mp-1211382
1.093274
1.727355
-5.330867
other
K4Sr8Cl20
32
14
889.22
mp-30537
13.163528
6.491428
-6.830225
other
Tb4P20O56
80
14
992.97
mp-770513
8.857574
12.762629
-0.02409
other
Li32Mn8O28
68
14
693.86
mp-1199380
9.022243
7.836224
-5.219217
other
Cu10P4O24
38
14
428.54
mp-1176476
9.97024
14.957547
-1.456329
other
Mn6O8F4
18
14
195.56
mp-755230
5.846993
12.425253
-2.462008
other
Fe6O8F4
18
14
197.94
mp-849991
10.207416
1.48526
1.960547
other
Li24Fe12F48
84
14
1,028.1
mp-756648
9.590868
8.683786
2.906291
other
Li4Nd4O8
16
14
233.31
mp-1211426
2.013471
2.562938
-3.696664
other
Ni2I20N12
34
14
1,273.91
mp-1047957
8.948514
2.337501
0.492577
other
Ba4Mo4F28
36
14
544.13
mp-755796
-4.645806
-1.155055
-5.287381
other
Li4Fe2S4
10
14
166.84
mp-556192
7.864831
3.435786
-3.965951
other
C16O20F24
60
14
824.28
mp-1190794
6.146279
5.410255
-4.263083
other
Hg4N4O16
24
14
484.35
mp-1195188
-3.25479
-3.917642
0.637262
other
Ca6Si16P28
50
14
1,034.48
mp-27241
1.456743
2.517743
-5.707562
other
K8Sb4Cl20
32
14
930.74
mp-31077
-1.174074
2.793217
-3.093124
other
Tl4Te2I12
18
14
763.37
mp-1213861
7.277098
8.175554
-3.454343
other
Co2P4O20
26
14
342.99
mp-974724
9.045911
9.845404
-3.454904
other
Re4Cl4O12
20
14
382.57
mp-554379
8.248431
2.251016
-0.836898
other
As4Xe4F44
52
14
852.55