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-758048
12.211599
7.499797
-7.495359
other
Li8Ni8P8O32
56
14
598.51
mp-17631
14.11765
8.131316
-5.759241
other
Fe4Ni2P4O16
26
14
306.75
mp-1194904
9.350964
7.38141
-3.400093
other
Cu4Hg4Se8O24
40
14
614.62
mp-1042542
10.393148
12.279429
-3.743259
other
Mg8V16Co8O56
88
14
1,085.58
mp-764842
11.023417
2.597247
0.828709
other
Li4V4O4F12
24
14
285.03
mp-1201462
8.056439
1.272482
-4.501433
other
H48Au8C24O16
96
14
1,184.44
mp-679987
1.2327
2.227489
-4.604415
other
Nb8P16S16Cl40
80
14
2,424.08
mp-727990
8.289795
6.322078
-4.859977
other
Ba4P16Pt4O56
80
14
1,681.35
mp-1210656
11.496119
7.235925
-4.125174
other
Mg2Zn4As4O16
26
14
360.2
mp-1202592
7.632715
8.000916
-3.908598
other
Fe8P8N4O44
64
14
907.58
mp-1193333
9.379635
7.421447
-5.04726
other
Cs4U2P4O20
30
14
594.4
mp-1214321
10.623893
5.950947
-3.007917
other
Ca4B24H12O48
88
14
1,204.06
mp-1042925
12.23577
8.399857
-3.998145
other
Ca4V4As8O28
44
14
648.61
mp-1047909
8.96026
1.156202
1.306487
other
Ba4Ca4Cr4F28
40
14
609.69
mp-1210319
11.301034
7.814499
-1.337052
other
Nd4Fe4Ge8O28
44
14
573.09
mp-1353766
13.082997
8.386012
-0.895152
other
Zn4Cr4Ge8O24
40
14
490.65
mp-1179436
6.812701
5.721606
-4.131464
other
Sr4Sb16S28O24
72
14
1,699.44
mp-17259
8.994225
1.064187
1.181302
other
Na4Sr4Cr4F24
36
14
522.73
mp-722832
9.484221
2.25501
-3.135877
other
P4H12N4F20
40
14
396.16
mp-1041041
9.315136
10.566676
-1.436885
other
Ca4Cu8Sb8O32
52
14
775.86
mp-1211588
3.217276
-0.091005
-2.366573
other
K4Zn4H24Br12
44
14
1,011.55
mp-1182694
8.057977
6.900806
-4.898873
other
K12Te4P12O68
96
14
1,810.84
mp-727800
6.494927
6.238616
-3.422804
other
Hg12I8Cl4O24
48
14
1,117.26
mp-1200031
7.190881
6.935532
-4.284707
other
Zn4Fe4S8O64
80
14
1,310.82
mp-680326
5.067698
2.733478
-3.655154
other
P24C48S48N72
192
14
3,865.25
mp-1194702
8.106339
0.912553
-4.102778
other
Li4B4H36N12
56
14
468.6
mp-1198003
8.871791
5.317075
-5.855815
other
Na2Au2S8O28
40
14
637.96
mp-760126
13.839086
8.683187
-7.315021
other
Na8V8P12O48
76
14
964.38
mp-558865
4.249239
3.086771
-4.074191
other
Se8S32N24Cl24
88
14
2,002.54
mp-726944
4.551054
3.007722
-3.668842
other
Ag4C8S8N12
32
14
690.12
mp-560687
-5.176618
-1.920271
-2.065651
other
Nb12Te32I28O4
76
14
2,924.07
mp-720739
11.33665
4.31938
-5.003312
other
Zn4P8H24O20
56
14
601.62
mp-1192562
11.558507
11.235395
-3.996412
other
Nd4Mo4O16F4
28
14
423.68
mp-707945
9.217909
4.453939
-4.190791
other
Ba4Zn8H64O44
120
14
1,437.92
mp-1202917
7.718469
6.557179
-4.86226
other
Cs4Pr4S8O48
64
14
1,164.82
mp-690868
14.209065
7.468529
-7.136537
other
Li12Mn12P12O48
84
14
964.14
mp-26887
14.468596
8.468095
-6.629473
other
Li4V4P8O28
44
14
505.47
mp-768553
10.055417
4.575567
-6.883793
other
Li12Cu8S12O48
80
14
961.72
mp-1203851
8.426501
6.278989
-5.599791
other
K8Zr4S12O56
80
14
1,349.84
mp-1020704
9.65027
4.808372
-6.475421
other
Sr4Ge2S16O56
78
14
1,105.21
mp-504271
9.469422
7.945946
-5.914199
other
Li12Ni8P12O48
80
14
950.61
mp-1041418
6.615597
11.145813
-1.661067
other
Mg4Co8Cu8O32
52
14
627.64
mp-729825
6.854403
6.140287
-4.027436
other
Te4Se4N8O40
56
14
992.75
mp-780667
8.361262
2.038691
-0.569725
other
Ca4Sb8H8F56
76
14
1,133.94
mp-17495
14.408652
7.43196
-5.123382
other
Rb4Ti4P8O28
44
14
643.7
mp-1215029
10.934782
12.154441
-3.537031
other
Ba8Gd4V12O44
68
14
1,082.73
mp-1336629
5.736787
12.150551
-2.181681
other
Zn8Fe16Co8O56
88
14
982.86
mp-770490
10.081591
4.651048
-7.041398
other
Li4Cr8S12O48
72
14
914.94
mp-554741
-2.392602
-0.597741
-5.277797
other
K4Er4P8S28
44
14
1,090.43
mp-1222583
10.45435
11.348619
3.080331
other
Lu4Ta4Ti4O24
36
14
422.4
mp-1043530
12.923443
8.106688
-0.970924
other
Mg4Fe4Ge8O24
40
14
481.87
mp-1042662
6.195418
9.683931
-1.514319
other
Ca8Co8Bi16O56
88
14
1,238.59
mp-1197361
11.059276
4.791437
-4.144687
other
Rb12Pu4H16O28
60
14
923.3
mp-572763
-0.256164
1.102087
-4.934546
other
Ta4P16S20Cl20
60
14
1,852.1
mp-1275144
12.475778
11.64182
-0.878024
other
V2Zn4W2O12
20
14
217.52
mp-1210169
7.591037
6.33924
-4.851056
other
Rb4Sm4S8O48
64
14
1,139.86
mp-758496
14.206831
7.375794
-6.0449
other
Li4Ti4P16O48
72
14
935.81
mp-706544
8.59936
1.24859
-3.860867
other
Na4Ga4H32N16
56
14
645.9
mp-771303
12.910696
5.331366
-3.060041
other
Li4Mn4B8O20
36
14
398.16
mp-555030
13.243009
5.97715
-6.822433
other
Na4Y4P16O48
72
14
943.2
mp-560042
7.606795
2.593394
-1.949595
other
As4S12N8F24
48
14
833.91
mp-1040991
6.715554
9.556219
-1.552177
other
Ca4Cu8Bi8O32
52
14
825.79
mp-1041318
12.784237
6.734447
-1.046026
other
Be12Si12Sn8O48
80
14
950.88
mp-1228769
9.167936
6.827238
-3.465448
other
Ca4Al8Si8O48
68
14
1,022.44
mp-1208871
5.965872
8.65243
-0.274102
other
Sr4Eu2Bi2O12
20
14
315.02
mp-1202735
6.932646
8.377289
-2.974609
other
Al4Fe2P4O36
46
14
677.12
mp-559294
9.851434
4.55901
-6.839731
other
K16W4S12O56
88
14
1,443.19
mp-554735
-2.844003
-1.040954
-5.13177
other
Hg4As16S16I8
44
14
1,578.07
mp-1043305
11.580279
7.714669
-1.489911
other
Zn4Ni4Ge8O24
40
14
473.93
mp-768418
13.00551
5.660205
-2.948541
other
Li12Mn4B8O24
48
14
467.33
mp-1196491
8.371625
2.316074
-1.161241
other
Sb4H4S4F40
52
14
784.82
mp-556473
14.64381
7.973125
-5.122925
other
Cr8P4Br4O16
32
14
489.29
mp-1203345
11.616478
4.449765
-4.665954
other
Rb8P4H20O24
56
14
719.35
mp-1200464
10.051979
10.193187
-1.960199
other
Fe12Te12Cl4O40
68
14
1,013.72
mp-683942
8.512915
6.529169
-3.79386
other
Ba4U4Se8O32
48
14
934
mp-1650136
14.927791
5.791745
-2.132117
other
Li8Fe2B4O12
26
14
247.6
mp-758392
7.833024
4.817548
-6.530272
other
Li4Co4C4O16
28
14
364.22
mp-1210515
6.712657
6.376057
-3.819093
other
Sm4I4Cl4O52
64
14
1,146.9
mp-1212715
11.460632
4.424702
-4.758528
other
Ga2P4H22O24
52
14
476.23
mp-705315
11.667123
7.702475
-7.39845
other
Li4Cr4P20O60
88
14
1,234.27
mp-1209385
12.945002
6.360448
-6.023384
other
Rb4Ag4P8O24
40
14
615.24
mp-560266
13.685159
4.300085
-2.279243
other
Na12B20S4O32
68
14
812.49
mp-541996
11.914901
8.312539
1.588156
other
Pr8Si4Te4O16
32
14
562.48
mp-1209764
8.358339
10.615574
1.390276
other
Pr4Ni2Pt2O12
20
14
252.56
mp-18703
13.935478
6.723546
-6.282292
other
Ba4Mn4P8O28
44
14
645.74
mp-1041343
8.533614
1.655776
1.143328
other
Ba4Ca4Sb4F28
40
14
655.65
mp-1203994
7.344733
7.366598
-3.935576
other
Te4Se4N8O40
56
14
1,138.1
mp-705089
14.65751
7.939641
-5.351569
other
Li4Fe12P12O44
72
14
876.99
mp-662607
6.580371
5.621665
-3.820691
other
Ce4P16Cl52O52
124
14
2,858.02
mp-1047850
9.388638
1.822191
1.50948
other
Ba4Mg4V4F28
40
14
551.62
mp-1203490
7.21377
7.221612
-3.740913
other
C4I4N8O28
44
14
745.34
mp-1194930
-2.35363
-0.516875
-5.31885
other
Pr4Tl4P8S28
44
14
1,132.45
mp-1043725
7.322013
9.263569
-0.621588
other
Mg4Ti4Bi4O20
32
14
460.71
mp-19465
13.913333
4.471701
-2.342528
other
Ho4Co4B20O40
68
14
619.8
mp-1209772
7.31778
7.518254
-3.974458
other
Rb4Co2S4O28
38
14
686.55
mp-731052
9.047427
6.440458
-3.98754
other
Mn4H8Se8O32
52
14
706.24
mp-557087
11.52261
10.711613
-3.060152
other
Na4Sb4Mo4O20
32
14
545.14
mp-1375228
11.986947
11.425103
-1.006092
other
Zn4Ir2W2O12
20
14
218.61
mp-1239255
-5.50426
-0.20958
-5.655795
other
Nb2Cr6Cu4S16
28
14
480.13
mp-24385
10.191876
3.065913
-3.942791
other
Mn4H32Cl8O16
60
14
658.5