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-1204226
-5.399973
-5.894087
0.691608
other
K4Eu8Cd8Sb12
32
62
1,006.48
mp-726091
1.960866
2.51474
-3.639623
other
I4Br4N4Cl4
16
62
604.8
mp-861542
11.362218
7.800528
-2.290268
other
Li4Fe4Si4O16
28
62
283.06
mp-1181074
4.389941
4.009178
-4.022659
other
Hg4N4Cl12O4
24
62
607.15
mp-653182
10.412973
4.418716
-7.021433
other
K32U8S24O112
176
62
2,980.55
mp-1007694
13.108243
6.332754
-7.222509
other
Sn4P4O16F4
28
62
360.88
mp-1202203
-2.689126
-0.382673
-4.789069
other
Cu12P16S12Br12
52
62
1,249.53
mp-1200432
12.340328
7.432828
0.757577
other
Ca8Al32Pb4O60
104
62
1,376.46
mp-1239127
-4.858847
-0.496935
-5.485171
other
Hf4Cr4Cu4S16
28
62
545.92
mp-735518
5.733541
5.188942
-3.511547
other
Fe4H8Cl20O12
44
62
875.97
mp-1204920
9.134356
5.407567
-5.37761
other
Sr4P12N4O48
68
62
1,213.98
mp-1219566
10.752718
11.772001
2.681817
other
Rb4Ti4Nb4O20
32
62
472.81
mp-1213564
7.103422
7.28767
-3.908164
other
Cu8Se8Cl8O40
64
62
1,053.59
mp-752412
13.067042
5.946497
-2.899806
other
Li8Fe4B4O16
32
62
302.6
mp-560214
2.557158
2.740321
-4.454568
other
Mo4P4Cl32O4
44
62
1,350.44
mp-774859
14.736567
8.064573
-4.252666
other
Li4Nb4P4O20
32
62
382.3
mp-1181745
9.190235
6.368122
-3.782784
other
K12B28Pt4O80
124
62
1,825.04
mp-1239174
-5.164945
-0.202586
-5.558704
other
Ti4Cr4Cu4S16
28
62
479.06
mp-567433
-0.124581
1.693955
-4.083445
other
B4P4I12Br12
32
62
1,303.62
mp-672688
7.900801
7.070862
-4.048962
other
Yb4Se4Cl4O12
24
62
467.79
mp-554160
12.817491
6.273986
-6.539754
other
K8Cu4P8O28
48
62
707.2
mp-977355
-6.483057
-6.223937
3.851322
other
Li4Yb8In4Ge8
24
62
529.34
mp-859784
14.123784
12.552761
-0.628634
other
Li4V8O12F4
28
62
318.74
mp-1198248
-4.61958
-2.814661
-3.63168
other
In8Bi12Se28I4
52
62
1,575.56
mp-768292
13.663528
5.36507
-2.3392
other
Li8Bi4B4O16
32
62
341.59
mp-554803
10.129762
11.947146
-3.441101
other
V4Pb4Cl4O12
24
62
414.25
mp-1205064
3.204873
3.077561
-3.940108
other
Cr4Pt4N20Cl20
48
62
1,279.24
mp-1208989
8.75414
6.691126
-3.925009
other
U4H20Se8O40
72
62
1,228.56
mp-559513
7.338829
5.398095
-2.754961
other
K8N4Cl4O12
28
62
463.4
mp-755753
11.547242
7.555472
-2.230273
other
Li4Mn4Si4O16
28
62
308.66
mp-1203642
12.939683
5.984086
-0.93367
other
K4Si8H4O20
36
62
503.77
mp-24576
10.732636
6.689659
-4.72924
other
V4Ag4H8O16
32
62
425.41
mp-1194980
10.347658
9.307417
-1.837361
other
K4Y4Te8O24
40
62
738.02
mp-1020637
13.775229
4.221699
-2.077896
other
Sr12Be4B24O52
92
62
1,065.41
mp-558871
10.688622
12.294445
-3.381226
other
Sr4V4Cl4O12
24
62
387.26
mp-1194824
6.482714
0.586606
-3.580128
other
Bi4B48H44O12
108
62
1,432.97
mp-1197632
9.580944
7.283837
-3.607255
other
Sr8V12Se20O72
112
62
1,718.75
mp-1194523
10.590694
11.399784
3.108823
other
Li8Ca4Ta8O28
48
62
547.2
mp-1215009
7.856383
11.291375
0.789707
other
Ba4Fe8Pb4O20
36
62
509.55
mp-760516
12.816769
7.316262
-1.565329
other
Li8Co4Si4O16
32
62
330.19
mp-1176443
14.158808
6.184067
-2.973641
other
Mn4Fe4B4O16
28
62
297.26
mp-559516
10.142561
4.426705
-7.118811
other
K12Nb4S16O64
96
62
1,549.44
mp-1192357
-4.721457
-5.673136
0.846524
other
Sr12Li4As8H4
28
62
687.2
mp-754048
12.030518
6.171211
-3.222806
other
Li4Mn4B4O16
28
62
237.07
mp-555844
-4.099436
-1.077877
-5.477644
other
Mn4Sb4S8Cl4
20
62
452.38
mp-6244
-4.532673
-3.659035
-4.01839
other
Ho4Cu4Pb4Se12
24
62
588.21
mp-554928
8.704683
1.229283
-4.317972
other
H48C12N4F12
76
62
676.47
mp-696701
9.860755
3.88095
-3.753744
other
H4Pb4Cl4O4
16
62
279.55
mp-1192030
9.754098
3.100243
-3.959467
other
Co4H8Cl8O4
24
62
364.3
mp-1324481
8.803846
7.939633
-4.966173
other
Mg4Ag8P8O36
56
62
719.09
mp-756369
11.245832
13.572191
-1.37719
other
Li4Al4V4O16
28
62
279.65
mp-1203828
9.8109
1.935573
-3.662994
other
Sb4H24N8F20
56
62
536.93
mp-629080
6.614418
3.247027
-4.238132
other
Fe8C36O28F16
88
62
1,255.02
mp-1210198
9.261893
7.281713
-3.420294
other
Na4Co8Se8O28
48
62
685.47
mp-556125
12.607801
4.360982
-3.114025
other
Na8B4H4O12
28
62
306.39
mp-1199375
11.443369
5.308568
-5.76289
other
Mn8H8S4O20
40
62
461.79
mp-1211764
13.29538
4.780165
-1.591735
other
K12Gd4B8O24
48
62
726.16
mp-1210660
9.507029
5.337199
-6.76336
other
Na4Fe4S8O32
48
62
618.33
mp-1209335
8.718289
0.582933
0.735841
other
Rb4Al4Ag4F24
36
62
550.57
mp-1190889
-4.446768
-3.840172
-3.963682
other
Sr4Gd4Cu4Se12
24
62
607.38
mp-1204484
6.906407
0.054392
-4.055381
other
Li8B12H56N4
80
62
666.96
mp-560255
2.463251
2.672748
-4.416575
other
Nb4P4Cl32O4
44
62
1,230.21
mp-1200343
-5.345049
-5.978119
0.670798
other
K4Ca8Cd8Sb12
32
62
973.35
mp-1238485
12.713341
7.420967
-1.654199
other
Ca4Fe12Si8O36
60
62
990.95
mp-1097054
7.969955
10.645657
1.704985
other
K4Ce8Fe4O24
40
62
585.13
mp-17033
8.760059
0.853761
1.068921
other
Cs4Al4Pd4F24
36
62
579.87
mp-554901
9.315282
7.614426
-3.871182
other
Ga8Mo4Se8O40
60
62
842.27
mp-17878
9.176169
8.710626
2.853498
other
Ba4Ho8Cu4O20
36
62
500.8
mp-752431
14.806052
8.574718
-3.807308
other
Li4V4P4O16
28
62
296.72
mp-1203387
-4.490641
-3.180415
-3.716531
other
Ba8Ga4Sb4Se20
36
62
1,123.32
mp-825626
9.058481
9.147273
2.620818
other
Ba4Lu8Ni4O20
36
62
479.61
mp-768731
13.696505
5.370002
-2.333677
other
Li8Bi4B4O16
32
62
346.17
mp-556223
8.191439
2.55379
-1.636857
other
C4S4N4F20
32
62
506.15
mp-1196462
2.353535
3.232006
-4.50396
other
K16Bi8Cl40O16
80
62
2,253.11
mp-560732
8.54332
1.29559
1.428783
other
Ba4Na4Zr4F28
40
62
594.36
mp-1193745
11.626519
7.222059
-4.429799
other
Ce4As4O16F4
28
62
426.28
mp-1214290
11.413629
10.988787
-3.775043
other
Cs12Pr4Mo12O48
76
62
1,659.36
mp-863383
9.965322
0.870397
0.0764
other
Li4Ni8O4F12
28
62
313.64
mp-758311
11.682431
7.424001
-2.250332
other
Li8Cu4Si4O16
32
62
341.34
mp-18245
12.763751
7.360497
-7.136927
other
Na4Co4P4O16
28
62
313.23
mp-1195713
-3.267204
-1.62499
-5.313035
other
Ba12Fe4S16Br4
36
62
1,040.57
mp-1192362
-3.191927
-2.216466
-5.675935
other
Sr4Gd4Cu4S12
24
62
532.33
mp-697084
9.711966
4.227981
-3.567607
original
H4Pb4I4O4
16
62
360.21
mp-1194561
9.607939
6.981561
-3.499218
other
Na4Sc4Se8O24
40
62
601.98
mp-568343
-1.084516
1.269186
-1.682831
other
K4Pr24Os4I40
72
62
3,144.92
mp-1192530
12.341419
6.249423
-5.256203
other
Cs4P4Pb4O16
28
62
536.04
mp-6493
12.421018
6.610142
-0.079636
other
Ca4Mg4Si4O16
28
62
351.45
mp-818571
10.226503
12.27195
-3.18302
other
Mn4V4Pb4O20
32
62
445.89
mp-505171
-4.103498
-0.779014
-5.522314
other
Na4Ti4Cu4S12
24
62
438.82
mp-1179660
7.33738
4.686088
-5.342334
other
Sn8C24N8O68
108
62
1,934.25
mp-558963
12.094522
7.094596
-2.897043
other
Hf4Ni20B8O40
72
62
718.96
mp-554063
9.556307
6.892735
-3.257242
other
Sm4Se4Cl4O12
24
62
481.91
mp-772563
10.352896
12.579988
-3.947577
other
Li8V4O8F12
32
62
366.06
mp-1195095
8.286138
1.986134
-0.522263
other
K4Cu4Sb12F72
92
62
1,632.13
mp-1209399
7.693744
1.954426
-4.608196
other
Rb4H8C4N20
36
62
508.44
mp-759909
10.049748
12.212214
0.193559
other
Li20Mn4O12F4
40
62
425.14
mp-1180428
4.781075
2.863858
-3.51554
other
Pd4C36N12Cl20
72
62
1,898.2
mp-780202
8.345654
13.694723
-0.670323
other
Li8Fe4O8F4
24
62
214.24
mp-1205075
-5.039017
-6.062136
0.665473
other
K4Ba8Cd8Sb12
32
62
1,145.72
mp-1210517
5.663644
5.663285
-3.236876
other
Rb4Pb4I12O8
28
62
1,071.45