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-1197828
10.551272
4.112135
-5.027772
other
Cs4Mn2H24S4O28
62
14
729.4
mp-1197316
13.525266
5.150773
-6.507667
other
Na8Sr4Mg4P8O32
56
14
643.92
mp-849240
13.849553
7.002941
-5.652049
other
Li4Fe6P8H8O32
58
14
651.73
mp-561998
9.576928
6.906341
-3.481884
other
Sr8Co4Se8Cl8O24
52
14
885.62
mp-1197129
9.87354
3.435306
-4.220326
other
Na32P16H96Se48O48
240
14
3,749.06
mp-1202931
8.402755
2.028834
-4.456649
other
Na16H48C16N32O16
128
14
1,350.14
mp-1209805
7.580098
4.055538
-2.142946
other
Rb4Be4Zn2O12F16
38
14
595.85
mp-600159
7.749601
1.925934
-4.297135
other
Ni4H16C8S16N8
52
14
806.84
mp-1201422
8.28631
1.047264
-4.504855
other
V8H112C48Cl8O28
204
14
2,377.22
mp-1199163
7.796557
1.269158
-4.389055
other
Li4H24C12Br4N8
52
14
740.25
mp-571507
8.163678
0.694022
-4.446231
other
Ta4H80C24N12Cl16
136
14
1,640.71
mp-722774
9.953671
3.336325
-4.359998
other
Ba12As8H56S32O28
136
14
2,104
mp-733598
9.072611
1.796886
-4.177806
other
H36Pt4N8Cl4O8
60
14
629.28
mp-1238309
13.289783
5.194808
-2.343049
other
Ca4Si4B4H4O20
36
14
407.97
mp-1202407
12.707705
4.296011
-3.121388
other
La4B20H20N4O56
104
14
1,068.63
mp-1213612
8.786241
2.705935
-4.913025
other
Fe4H72C24N24O52
176
14
1,681.37
mp-568314
8.328259
0.728786
-4.501272
other
Co4H64C16N8Cl16
108
14
1,355.27
mp-1199469
9.958097
4.500945
-5.326676
other
Na12H16Au4S16O32
80
14
1,167.7
mp-15182
4.268667
2.311012
-3.26493
other
Rb4Li2Co2C12N12
32
14
557.83
mp-1201576
11.275936
4.395778
-4.743681
other
Zn4Cu8P4H28O36
80
14
754.34
mp-1196625
10.154035
4.667028
-4.491155
other
K4Co2H24Se4O28
62
14
736.54
mp-1193600
4.146848
3.170841
-3.722876
other
Zn2C4N12Cl4O4
26
14
626.96
mp-720860
10.070631
3.127398
-3.776671
other
H36C4S4O28F12
84
14
881.09
mp-851030
14.43789
7.499848
-5.927438
other
Li8Fe4P4H4O20
40
14
431.28
mp-1047872
13.561522
8.310652
-0.669985
other
Mg4Ti8Be12Si12O48
84
14
875.64
mp-1212181
7.373553
6.168892
-4.510389
other
Mn4S4N8O16F12
44
14
786.25
mp-735536
9.569857
7.029238
-3.678928
other
Ba2V4H4Se8O28
46
14
638.35
mp-1211841
9.440034
1.635545
-3.44159
other
K2H16W2N4F12
36
14
397.97
mp-768108
9.229173
4.761222
-8.315824
other
Na8Fe4P4C4O28
48
14
612.82
mp-558517
7.833474
9.888748
-3.655088
other
K8Cr8Hg4Cl8O28
56
14
1,136.22
mp-1197105
11.841916
4.674791
-5.164424
other
V4P8H16N4O28
60
14
628.43
mp-776424
13.941568
6.775541
-5.947957
other
Na8Li4Cu4P8O28
52
14
656.47
mp-1200286
8.751893
1.176547
-4.015599
other
Mn4Te4H72S12N24
116
14
1,476.7
mp-1212230
9.833783
4.509621
-6.471925
other
K4Co2H4S4O16
30
14
455.27
mp-17241
4.246702
2.291897
-3.229207
other
Rb4Li2Fe2C12N12
32
14
564.34
mp-1179366
4.92485
2.80525
-3.562267
other
Ti4Si4C28N4Cl12
52
14
1,309.51
mp-1181919
8.075728
8.778688
-3.942169
other
K8U8Cr8H8O68
100
14
1,716.83
mp-1204852
1.902765
2.465365
-5.045341
other
Cs8Mo8S8Cl16O16
56
14
1,722.64
mp-23666
9.240005
2.331039
-4.547771
other
As4H32C4N12O16
68
14
687.39
mp-722275
10.443748
3.475966
-4.551761
other
Cu2H40S4N4O28
78
14
702.61
mp-720461
9.119555
2.214934
-4.562286
other
P12H88C12N36O44
192
14
2,013.69
mp-24438
10.591119
4.088148
-4.923779
other
K4Mg2H24S4O28
62
14
679.5
mp-727978
9.636992
2.920925
-4.589891
other
V4H32N8O20F4
68
14
580.54
mp-774386
14.287537
7.279645
-5.690305
other
Li4Cr6P8H8O32
58
14
673.5
mp-24573
9.430115
3.517385
-5.628558
other
K4Ni2H16C4O20
46
14
485.63
mp-1202628
9.262439
2.741757
-4.808557
other
V4H24C8S8O28
72
14
892.96
mp-695057
10.569103
11.258239
0.65843
other
Sr16Nd4Fe10Mo10O60
100
14
1,288.82
mp-1211742
11.182345
4.018307
-7.492244
other
K4Tb4H4S8O32
52
14
794.06
mp-1047879
13.578897
8.271892
-0.687937
other
Ti8Be12Zn4Si12O48
84
14
889.2
mp-1201921
8.732479
2.071618
-0.460427
other
Na4Sb8H8O4F28
52
14
737.56
mp-694189
5.581574
3.372209
-4.613085
other
Co12Sn4C48Cl4O48
116
14
2,244.28
mp-505561
11.676872
4.510448
-4.850954
other
Na4Zn2P8H32O40
86
14
872.71
mp-1204422
10.925807
3.711802
-4.549199
other
Mg4P8H40N8O32
92
14
860.16
mp-542284
10.162416
4.66734
-4.519697
other
Rb4Co2H24Se4O28
62
14
746.56
mp-1198442
7.241842
6.439254
-4.441755
other
Cu8P4C8S4O52
76
14
1,248.33
mp-1199995
4.522827
2.826283
-3.731652
other
Cd4C8S8I8N16
44
14
1,086.25
mp-1201634
8.961929
4.006657
-5.408886
other
Na8S16N8O32F16
80
14
1,238.87
mp-733509
12.767214
5.902172
-1.525938
other
Na4Ti2Si8H8O26
48
14
550.77
mp-849433
9.708138
2.139309
-1.614205
other
Sr4Ti4H16O8F24
56
14
668.19
mp-1212361
6.868058
3.303311
-4.961462
other
K4H8C16N12O16
56
14
1,190.78
mp-1212259
7.358105
7.976416
-3.411747
other
K4Be4Co2O12F16
38
14
534.57
mp-1237444
8.159423
2.82884
-1.398571
other
Be4Tl4Zn2O12F16
38
14
538.98
mp-600182
8.29794
0.872685
-4.510054
other
Cd4H32C8Br12N4
60
14
899.1
mp-732227
8.402139
6.91569
-4.397079
other
Sb4As4N4O16F8
36
14
731.88
mp-1199586
7.911664
0.473378
-4.479527
other
K4Si28H248C100O24
404
14
4,812.26
mp-24038
10.462666
4.078615
-4.946224
other
K4Cu2H24S4O28
62
14
675.18
mp-600200
10.429399
4.54989
-4.306768
other
V12H24C4N4O28
72
14
848.88
mp-24624
9.55903
3.552761
-5.648452
other
Rb4Co2H16C4O20
46
14
523.73
mp-1181488
10.672081
3.094596
-4.550713
other
Fe4P4H24N8O16
56
14
505.2
mp-1180615
9.348363
5.110921
-4.123719
other
Na8Te2H20Se4O32
66
14
844.45
mp-1213522
11.553084
8.746971
-5.574405
other
Cs4Rb4Mo12P12O68
100
14
1,592.96
mp-39167
12.398805
6.645448
0.361011
other
Ca4Sc4Al4Si4O24
40
14
482.66
mp-567899
7.863779
0.219507
-4.447935
other
Rb4Si8H72C24N4
112
14
1,262.73
mp-1195205
11.359563
3.829803
-4.784779
other
Li4P8H32N4O32
80
14
762.6
mp-1196467
12.469561
6.838984
-6.787354
other
Rb4Cu6P8O24F8
50
14
706.26
mp-1201277
8.501439
2.156435
-0.989092
other
Hg4As10H12O4F62
92
14
1,252.02
mp-720876
10.404514
4.12001
-4.945597
other
Cs4Cu2H24S4O28
62
14
831.43
mp-1173574
12.414347
6.71304
-0.585191
other
Nd8Ti6Co4Si8O44
70
14
844.61
mp-703283
8.109471
10.760901
1.49424
other
Sr4La4Mg2Ru6O24
40
14
507.4
mp-1199970
11.39434
7.612683
-7.387609
other
K4Fe4Cu4P8O32
52
14
671.54
mp-24133
10.425476
4.124976
-4.901649
other
K4Ni2H24S4O28
62
14
666.1
mp-728393
8.34045
2.14083
-1.314467
other
K4Zr4Cu2O12F24
46
14
753.55
mp-1199259
8.115184
2.322347
-0.980823
other
As4Xe8Br4O4F48
68
14
1,355.71
mp-706676
10.818679
3.744299
-4.688908
other
K8P8H24N8O24
72
14
880.37
mp-557360
8.009994
2.440021
-1.410482
other
As4P4Cl12O4F20
44
14
935.7
mp-1196677
5.135062
3.00262
-4.380368
other
Cs4Os4C12Cl12O12
44
14
1,078.72
mp-1212303
4.374602
2.293891
-3.171964
other
K8Mo2C8N8O4
30
14
648.59
mp-1201482
8.578601
1.330156
-4.446531
other
Na4Mo8H100C32O40
184
14
2,028.63
mp-24493
11.263006
4.141953
-4.477294
other
Na12Mn4P12H96O88
212
14
2,106.12
mp-729576
13.601054
7.673583
-1.328555
other
Mn24V4Si20H4O76
128
14
1,524.65
mp-759665
10.386755
3.551822
-4.452343
other
Zn2H40S4N4O28
78
14
761.51
mp-559089
5.557909
3.372216
-4.128767
other
P4S8N12Cl16O8
48
14
1,114.15
mp-1201360
4.797011
1.981024
-2.431005
other
Ba8Mg2C8N16F4
38
14
593.37
mp-1203750
8.077871
0.495412
-4.470505
other
Sn4H80C28I4N4
120
14
1,547.9
mp-541298
9.265002
1.657077
0.076081
other
K8Hf8H16O8F40
80
14
1,039
mp-555996
6.846961
4.954869
-4.445031
other
C4I4N8O24F12
52
14
836.77
mp-759104
14.252407
8.224756
-5.483072
other
Li4V12P8H16O48
88
14
919.06
mp-541750
9.045462
4.198736
-5.641998
other
Cs4S8N4O16F8
40
14
752.1
mp-1179271
4.326002
2.784191
-3.988319
other
Ti4Si8C16N8Cl16
52
14
1,594.6
mp-1197750
9.770845
3.088958
-4.481331
other
H48Os4S4N16O28
100
14
976.23