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-1197481
8.128558
6.424867
-5.250007
other
Na8Hf4S12O60
84
19
1,237.36
mp-26001
12.455404
7.442773
-7.334804
other
Li4Ni4P12O36
56
19
626.35
mp-561328
7.715302
2.408434
-1.173553
other
Sb4Se4Br12F24
44
19
1,065.91
mp-1180450
8.157776
6.627031
-3.477448
other
Li4V4Te4O20
32
19
562.06
mp-721268
9.797676
4.040867
-4.649558
other
H24S4N8O16
52
19
557.02
mp-1196457
13.510473
4.321337
-2.333535
other
Li8B12O16F12
48
19
515.49
mp-1203085
12.797616
6.245265
-0.470385
other
Na48Y16Si48O144
256
19
3,591.02
mp-560431
13.022294
5.989748
-6.616944
other
K4Be4P12O36
56
19
806.29
mp-1178861
11.185376
5.032826
-5.191378
other
Zn12P8H28O48
96
19
1,040.72
mp-1330276
10.170936
7.9743
-5.244772
other
Mg4Co4As4O20
32
19
379.64
mp-696941
8.455558
9.247683
-2.360626
other
K8H8Ru4O20
40
19
599.48
mp-1180682
3.212693
-0.774614
-2.182793
other
La4Mg8H28Pd4
44
19
454.39
mp-1180329
10.915781
6.808167
-1.743699
other
Na8Zr4Si12O40
64
19
998.99
mp-765590
14.749113
7.783618
-5.803427
other
Li4Fe4P4O16
28
19
314.31
mp-1179765
8.502034
7.337422
-4.950059
other
Rb4Zn8P12O56
80
19
1,427
mp-541900
9.749329
1.82929
-4.023891
other
Al4H60N24F24
112
19
889.78
mp-1200465
8.24838
3.289188
-4.78299
other
H16C8N16O16
56
19
567.93
mp-1223201
14.818761
8.115113
-5.270373
other
Li4Cr16P12O48
80
19
966.27
mp-558923
7.850638
10.034735
-3.784723
other
K4Tb4Cr8O32
48
19
744.87
mp-1214441
13.195005
6.212253
-6.142721
other
Ba4Tl4P12O36
56
19
937.91
mp-759435
12.505237
7.323413
-7.189778
other
Li4Cu4P12O36
56
19
641.64
mp-735027
8.151157
6.671572
-5.30207
other
V4S8N4O36
52
19
806.64
mp-1194701
-4.64804
-2.967078
-3.798912
other
Cs8Zn4Sn12Se32
56
19
2,061.31
mp-1195323
-4.596272
-2.947939
-3.824455
other
Cs8Sn12Hg4Se32
56
19
2,120.86
mp-729572
8.35582
1.925517
-1.801284
other
Cs8B48O4F48
108
19
1,621.86
mp-1194142
-3.302425
-1.718587
-5.688413
other
Cs4Tb4Si4S16
28
19
769.57
mp-630711
-3.309603
-1.766448
-5.715063
other
Cs4Gd4Si4S16
28
19
784.07
mp-26401
12.428454
8.087556
-6.569616
other
Li4Mo4P16O52
76
19
1,023.54
mp-26126
12.09395
7.59839
-7.561219
other
Li4Fe4P16O48
72
19
907.18
mp-1047058
11.92143
7.706849
-3.62254
other
Ca4Sb4As4O20
32
19
497.09
mp-1210039
9.213569
1.951284
1.502036
other
Na4Sr4V4F24
36
19
550.54
mp-1201866
8.442058
2.996917
-3.659101
other
H8C16O12F24
60
19
670.77
mp-735543
10.747897
4.24613
-4.668077
other
Mn4H24S4O24
56
19
571.51
mp-642398
8.94285
5.590889
-6.578287
other
Rb4V4S4O24
36
19
558.97
mp-757989
13.800347
8.41028
-5.712451
other
Li4P8W4O32
48
19
675.28
mp-780731
14.043807
7.197485
-6.094073
other
Li8Cu4P12O36
60
19
701.04
mp-779068
13.023281
4.75282
-2.889462
other
Li12Mn4B24O52
92
19
914.6
mp-1047268
11.141875
7.941729
-4.829795
other
Mg4Fe4As4O20
32
19
424.14
mp-758184
14.157299
7.440326
-6.401848
other
Li4Fe4P12O36
56
19
657.65
mp-1346852
12.272915
8.01519
-4.339202
other
Zn4Cr4As4O20
32
19
409.48
mp-1219058
-2.844725
-2.7263
-4.597501
other
Sm4Th4U4S20
32
19
717.34
mp-1223001
-2.837209
-2.711346
-4.55391
other
La4Th4U4S20
32
19
731.92
mp-1200304
8.775273
10.806419
-3.385487
other
V4Zn4Pb4O20
32
19
448.76
mp-766687
12.947107
6.466903
-1.012079
other
Li8Si16Ni4O40
68
19
946.17
mp-699475
6.731446
1.094267
-3.657245
other
Ca4B48H48O32
132
19
1,466.49
mp-1200281
7.805933
1.026491
-4.364179
other
H72C24Se8N24
128
19
1,367.57
mp-1204204
8.530951
7.079126
-5.10198
other
Nd4P8H8O32
52
19
808.34
mp-560642
12.707614
5.643684
-6.987733
other
Na12Sb4P8O36
60
19
794.76
mp-703568
10.194693
4.551446
-5.952358
other
Ba4H8S8O32
52
19
691.37
mp-6787
13.810503
4.107278
-2.281228
other
Rb8Li8B32O56
104
19
1,319.85
mp-757519
12.958964
6.447495
-0.980164
other
Li8Co4Si16O40
68
19
967.21
mp-1219855
-2.822764
-2.734191
-4.589949
other
Pr4Th4U4S20
32
19
728.7
mp-1219040
8.928736
3.50078
-6.74819
other
Sm4H4C4O16
28
19
308.59
mp-775564
12.6124
13.425321
-0.71045
other
Li8Ti4V12O32
56
19
605.51
mp-1212581
8.598634
2.171026
-4.565783
other
H48C4N40O12
104
19
912.98
mp-555546
8.128351
2.041901
-0.688986
other
Mg4As8Xe16F80
108
19
2,131.95
mp-24354
10.154035
4.036709
-4.312902
other
H28Se8N4O24
64
19
690.83
mp-757889
13.661029
6.829816
-5.871376
other
Li4Sn4P12O36
56
19
1,001.84
mp-556979
-3.493824
-1.513145
-5.483013
other
Cs4Sm4Ge4S16
28
19
817.88
mp-1358881
11.490874
7.396733
-3.850358
other
Mg4Bi4As4O20
32
19
477.06
mp-559224
11.9793
7.32052
0.98806
other
Sr12Al8Cl8O20
48
19
860.24
mp-758707
9.233514
13.933514
-0.751763
other
Li8Mn12W4O32
56
19
659.97
mp-650996
5.553868
3.257463
-4.684664
other
Ru28C80S8O80
196
19
3,569.38
mp-865018
-4.254802
-1.453632
-5.049454
other
Cu4Bi4Pt4S12
24
19
483.62
mp-758977
11.297912
7.839283
-2.130892
other
Li4Fe4Si4O16
28
19
307.96
mp-722790
8.873617
6.794321
-5.36106
other
Ce4P8H8O32
52
19
751.64
mp-1047240
12.30942
11.104537
-1.573753
other
Mg4As4W4O20
32
19
448.54
mp-672984
10.792969
7.83636
-7.026218
other
Li4Cu4P16O48
72
19
881.58
mp-1343018
12.523496
7.760106
-4.196528
other
Ca4Cr4As4O20
32
19
404.06
mp-15250
13.020597
6.192451
-6.456073
other
Na16Cd16P48O144
224
19
3,341.76
mp-1209926
12.11152
7.131587
-0.874011
other
Rb12Ta12Ge12O60
96
19
1,659.4
mp-571057
-4.147134
-2.530626
-3.209816
other
K4Y4P8Se24
40
19
1,131
mp-1226127
-4.323708
-1.60652
-5.515703
other
Cu12Bi8S16Cl4
40
19
878.57
mp-1199664
7.481065
6.915633
-4.152765
other
Mo4N8O12F8
32
19
596.61
mp-1219615
6.653667
4.688589
-4.226873
other
Rb4S4N4O4
16
19
426.65
mp-758147
12.511406
7.168408
-6.877616
other
Li4Cu4P12O36
56
19
869.12
mp-759965
10.165617
1.44666
0.104102
other
Li12V4O4F24
44
19
437.74
mp-6724
10.270635
4.366806
-7.174312
other
K8Cd8S12O48
76
19
1,133.48
mp-1193820
7.884685
5.538534
-5.089022
other
K4S4N4O16
28
19
518.11
mp-686949
7.516437
7.111897
-3.601053
other
Th4Cr4I8O40
56
19
855.45
mp-1204359
4.877316
2.819665
-3.443569
other
Hg4C32I16N8
60
19
2,163.59
mp-1208802
11.498727
7.533016
0.526632
other
Sr12Ga8Cl8O20
48
19
881.14
mp-1220134
8.908256
3.477502
-6.62614
other
Nd4H4C4O16
28
19
317.26
mp-1019548
9.514463
4.921027
-6.336695
other
Ba4Ge4S24O84
116
19
1,672.97
mp-24022
9.584159
6.157097
-3.89237
other
Rb4H12Se8O24
48
19
718.84
mp-23140
-0.977707
1.73324
-4.443583
other
Ag4Hg4S4I4
16
19
476.03
mp-1204140
7.614424
4.398628
-4.616937
other
Mn8H32N16O64
120
19
1,294.49
mp-758723
14.075953
7.504807
-6.276099
other
Li4Fe4P12O36
56
19
687.59
mp-1198694
13.619394
8.238245
-6.326581
other
Cs4V4P4O20
32
19
587.25
mp-757970
12.45186
7.399595
-7.364558
other
Li4Ni4P4O16
28
19
304.97
mp-780424
13.737421
7.24726
-6.819521
other
Li4Mn4P12O36
56
19
705.39
mp-630859
5.831157
3.312129
-4.767775
other
Mn8C28S8O28
72
19
1,242.76
mp-557778
14.418069
4.592641
-6.293233
other
Rb12Nb12Si12O60
96
19
1,590.74
mp-707767
11.362576
4.555082
-3.702103
other
Na16Sn16H32O40
104
19
1,505.69
mp-721442
9.55897
5.397749
-4.491909
other
P4H20N8O16
48
19
478.43
mp-1214911
8.255226
2.514422
-1.26102
other
As4Xe4O12F24
44
19
751.15
mp-1326455
9.615778
8.1716
-4.613395
other
Zn4Cu4As4O20
32
19
402.38
mp-19513
12.482531
8.792011
-5.208153
other
Sr4V8As8O40
60
19
824.11
mp-1195448
10.054545
4.677416
-6.8543
other
Cs4Sb4S8O32
48
19
810.2
mp-1178070
12.578354
6.483529
-1.10395
other
Li8Cu4Si16O40
68
19
937.84