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-696778
10.758636
10.925707
-3.779781
other
Cu6Mo4H4O20
34
14
439.92
mp-736257
5.423771
2.825824
-3.422047
other
Te2As4C96Cl8
110
14
2,326.25
mp-683922
12.397547
7.153656
-0.797949
other
Ce12Ge18B4O60
94
14
1,047.48
mp-569704
4.158072
2.236527
-3.25018
other
Tl4Ni2C8N8
22
14
425.58
mp-1195880
10.815143
12.222838
-3.521059
other
Ba12Mg4V16O56
88
14
1,399.96
mp-15363
11.498299
6.189111
-3.099241
other
Li24Yb4B12O36
76
14
781.85
mp-768236
13.365706
5.248506
-2.865868
other
Li4Fe4B8O20
36
14
366.64
mp-1210905
7.59702
7.312868
-4.344334
other
Na4Co2S4O24
34
14
483.77
mp-622294
-0.616905
1.274053
-4.627471
other
Hg8Pb4S8Br8
28
14
1,314.32
mp-9660
13.486326
4.765421
-2.147673
other
Sr4Cu2B4O12
22
14
282.22
mp-696087
7.692771
6.468554
-4.701801
other
La4P8H8O36
56
14
899.48
mp-1367801
12.070312
10.731359
1.223635
other
Ca4Ti2W2O12
20
14
241.44
mp-760957
9.999976
7.571636
-6.213648
other
Na4Cu4P8O28
44
14
608.85
mp-1209670
13.919983
4.208228
-2.179136
other
Pr4Mg4B20O40
68
14
643.82
mp-646129
-3.321881
-1.472523
-5.191432
other
Rb4Eu4As4S12
24
14
678.41
mp-555646
9.03694
3.486386
-5.595246
other
Ba4H16C8O24
52
14
586.47
mp-1203506
10.347732
4.417885
-4.364693
other
Mg8H72Se8O68
156
14
1,514.17
mp-650140
5.652019
3.394431
-4.639484
other
In4Co12C48O48
112
14
1,991.5
mp-767598
13.338698
8.843751
-7.057458
other
Li4V4P4O20
32
14
423.26
mp-1214852
10.938953
12.236049
-3.5735
other
Ba8Tb4V12O44
68
14
1,069.18
mp-770362
12.868252
9.626515
-0.03218
other
Li12Al8V4O24
48
14
490.88
mp-734454
10.194245
4.594373
-4.23473
other
Na8Cr4H32O32
76
14
830.04
mp-980108
8.471725
10.35467
1.758902
other
Sm4Mg2Ir2O12
20
14
243.9
mp-1200123
13.207591
5.937364
-6.782338
other
Na4Sm4P16O48
72
14
963.06
mp-25840
13.524669
6.034167
-7.583011
other
Li4Ti8P12O48
72
14
902.91
mp-705400
9.56275
7.971372
-6.067881
other
Li4Cr8P12O52
76
14
920.4
mp-1228190
7.979419
11.913356
1.112453
other
Ca12Mn8W4O36
60
14
717.41
mp-557449
7.546004
7.324744
-3.594396
other
K4Cr4I4O24
36
14
622.78
mp-759875
11.446692
7.339709
-7.37366
other
Na12Fe8P12O48
80
14
1,014.68
mp-15002
6.914821
10.293938
0.558105
other
Sr4Ca2Ir2O12
20
14
284.66
mp-720571
10.139652
3.109011
-3.833376
other
Ca6H48Cl12O24
90
14
1,083.29
mp-26627
14.409842
8.519074
-5.088326
other
Li4Mo4P8O28
44
14
507.46
mp-1047531
12.365467
7.686348
-3.865058
other
Ca6Fe6As8O32
52
14
748.73
mp-733988
8.694497
5.802291
-6.134231
other
Rb4Ho4S8O36
52
14
801.42
mp-1342933
9.316979
12.207366
0.174515
other
Mg4Ti2Ir2O12
20
14
206.47
mp-705357
11.312482
8.042187
-7.982643
other
Li4Mn4P8O28
44
14
517.77
mp-753522
10.448192
12.004693
0.344429
other
Li8Mn2O4F4
18
14
184.15
mp-818285
12.864648
8.878403
-5.694964
other
K6Mo8P8O44
66
14
968.87
mp-1197647
11.510336
11.201375
-3.84663
other
Pr8Mo8Cl8O32
56
14
908.86
mp-1203377
11.497196
7.51461
-7.708656
other
Rb4Mn4P8O28
44
14
628.35
mp-1224569
10.295774
4.560392
-4.716272
other
K8P4H16O28
56
14
699.7
mp-559284
13.679775
4.497674
-1.971247
other
Rb8Al8B8O28
52
14
809.22
mp-1213302
13.489712
5.340496
-6.595232
other
Cs4Tb4P8O28
44
14
767.37
mp-1214203
9.573956
6.606946
-3.324797
other
Ca8B12Cl4O32
56
14
761.78
mp-722780
12.515083
5.261282
-5.424606
other
Pr8P12H20O40
80
14
992.45
mp-1202747
10.539548
4.102081
-3.895808
other
Sr4H16Pt2O16
38
14
377.4
mp-1040904
7.649186
10.884926
-0.960278
other
Mg4Ti8Cu8O32
52
14
647.56
mp-555862
6.184175
4.946352
-4.615336
other
Cs4Zr4N20O60
88
14
1,376.98
mp-1227217
11.710387
10.249578
3.35491
other
Ca4Ta4N4O8
20
14
250.14
mp-1199706
11.637956
4.412978
-3.706568
other
Na16Si16H72O76
180
14
1,810.99
mp-1041405
6.795486
11.350074
-1.604202
other
Mn8Zn4Cu8O32
52
14
631.95
mp-11912
7.58495
10.384808
1.214717
other
Na2Nd4Ir2O12
20
14
266.67
mp-1180155
8.71733
3.826365
-4.653715
other
Ni2H24C8O20
54
14
720.92
mp-1047775
11.293231
7.722281
-4.533099
other
Mg6Co6As8O32
52
14
664.89
mp-778474
11.874086
6.030402
-3.435649
other
Li12Co4B8O24
48
14
448.09
mp-757819
12.155383
7.512186
-7.416577
other
Li12Ni12P12O48
84
14
960.86
mp-757969
12.933479
7.669207
-7.262773
other
Li12Co12P12O48
84
14
986.66
mp-1348661
11.932158
11.108946
-2.883214
other
Mg4Cu8Mo8O32
52
14
712.12
mp-655124
14.436515
7.763954
-5.708552
other
Li4Fe6P8O28
46
14
606.79
mp-761060
11.460512
7.338479
-7.370137
other
Na12Fe8P12O48
80
14
1,005.82
mp-24476
9.418191
3.247689
-5.180843
other
Mn4H24C8O24
60
14
632.22
mp-1213246
7.214833
11.045832
0.451081
other
Eu4Ni2Ru2O12
20
14
243.51
mp-761052
12.347095
7.336885
-7.214426
other
Na4Ni6P8O28
46
14
539.14
mp-31763
10.590787
10.957121
0.82944
other
Ca8Fe4Re4O24
40
14
459.46
mp-568590
3.185862
2.950668
-4.042707
other
Sb4C4N4Cl20
32
14
958.34
mp-19980
11.271259
7.778222
-1.3207
other
La4Fe4Ge8O28
44
14
587.73
mp-1019777
13.320848
4.973258
-1.392576
other
K8La8B8O28
52
14
752.62
mp-759493
13.602117
7.186639
-6.250701
other
Li4Sb4P8O28
44
14
569.88
mp-1042772
12.410769
7.592831
-4.228516
other
Mg4Cr4As8O28
44
14
571.6
mp-734045
9.460981
6.829729
-3.773827
other
Cu8H8Se8O28
52
14
645.51
mp-1197421
6.245245
5.137051
-4.479129
other
K8Ru4N20O40
72
14
1,166.35
mp-1203958
9.585811
7.375602
-5.752627
other
K4Er4P8O36
52
14
823.1
mp-1041202
12.403634
6.486919
-1.084628
other
Be12Si12Bi8O48
80
14
987.89
mp-1198077
-2.090101
0.210962
-3.114817
other
Te48W16Cl64O16
144
14
4,418.82
mp-777273
13.315998
7.8348
-7.420906
other
Li4Cr4P8O28
44
14
534.3
mp-560476
9.837
8.664457
0.292805
other
Rb12Na4Ti4O16
36
14
719.3
mp-1196593
13.05954
6.388143
-0.723547
other
K8Si16Sb4O44
72
14
1,100.44
mp-559036
12.719184
8.693378
-5.899445
other
Na4Mo8P12O52
76
14
1,043.44
mp-557952
13.067525
5.620289
-6.769991
other
Rb4In4P8O28
44
14
674.09
mp-1198126
13.007464
6.300076
-6.724019
other
Na4U4P12O44
64
14
938.15
mp-1043243
11.690262
7.639641
-1.239505
other
Mg4Ni4Ge8O24
40
14
463.81
mp-733932
9.461514
1.585834
-3.908614
other
In4H20N8F8
40
14
378.46
mp-1195453
8.313411
2.172379
-0.891852
other
Ni4Sb12Xe4F92
112
14
1,840.17
mp-1199112
8.603309
8.134349
-4.409512
other
Ba4V4As8O40
56
14
829.71
mp-16796
7.838261
10.560912
1.479859
other
Sr4Gd2Ru2O12
20
14
278.01
mp-778115
13.632671
5.412084
-2.170111
other
Li8Bi4B4O16
32
14
401.57
mp-1042650
12.103354
10.989703
-2.553048
other
Zn8Co8Mo16O56
88
14
1,201.82
mp-1047077
14.162868
8.393839
-2.884086
other
Ca2Ti6P8O28
44
14
529.1
mp-1210821
7.19388
7.527998
-3.866561
other
Na4Ni2S4O28
38
14
513.78
mp-26773
11.803
7.566984
-7.817986
other
Li6Fe2P4O16
28
14
281.84
mp-759455
13.803297
7.236441
-6.166563
other
Li4Sb4P8O28
44
14
554.8
mp-1291397
11.374901
11.976266
-1.474737
other
Mn2Zn4W2O12
20
14
226.28
mp-1197620
-4.025132
-2.510268
-3.371792
other
K12As4P12Se36
64
14
1,969.92
mp-1214135
10.067477
10.108852
2.897281
other
Ca4Ta2In2O12
20
14
257.93
mp-1201951
8.403309
7.473854
-4.461485
other
Ce4As4O20F4
32
14
473.98
mp-557823
8.245178
2.419101
-1.025938
other
Sb4Xe4O8F28
44
14
770.4
mp-761152
10.083574
1.380812
-0.512389
other
Li4Ni4O4F8
20
14
197.16
mp-1264218
13.566862
7.198421
-0.843063
other
Li8Mn8Si12O36
64
14
868.36
mp-582708
-4.573795
-2.858327
-3.55783
other
Cs12Ge4As4Se20
40
14
1,542.68
mp-555288
7.886371
2.347208
-1.340612
other
Sb4S4Br12F24
44
14
923.37