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-1641247
13.659187
7.314803
-7.322428
other
Li8Mn4P8O28
48
62
646.36
mp-1041009
11.560635
7.842567
-7.495437
other
Mg4Fe8P8O36
56
62
663.61
mp-758987
8.92196
9.493814
-0.057214
other
Na40Cu8H8O32
88
62
1,205.8
mp-723109
9.453979
5.086145
-4.208776
other
Be4H56I16O72
148
62
1,698.26
mp-561437
12.30932
7.035882
-0.470367
other
Al8Ge4O16F8
36
62
377.92
mp-643036
9.906373
3.659172
-3.515506
other
Ba4H4Br4O4
16
62
353.33
mp-1228674
8.851998
1.075431
1.527315
other
Ba8Al4Zn4F36
52
62
762.75
mp-556514
11.829401
7.286302
-2.826228
other
Ni20Sn4B8O40
72
62
719.56
mp-1199198
13.719789
4.352535
-2.219414
other
Al8B12H4O32
56
62
692.9
mp-554028
6.743286
10.573013
-1.551392
other
Na40Li8Mn16O64
128
62
1,706.23
mp-628735
-2.471721
-0.684881
-5.42066
other
K4Eu4P4S16
28
62
732.78
mp-1237028
-3.490166
-4.141501
1.006691
other
K4Ga4P8H8
24
62
505.63
mp-1197966
5.344747
-0.42714
-2.989729
other
K4Li4B8H32
48
62
490.29
mp-753996
10.634443
1.202
1.72753
other
Li4Mn8O4F12
28
62
349.41
mp-1194352
4.652422
4.141593
-3.890176
other
Ag4I12N8O4
28
62
787.82
mp-542157
12.036851
7.704264
-6.933143
other
Fe4Co4P4O20
32
62
362.21
mp-23587
9.690626
6.883958
-3.262103
other
Ho4Se4Cl4O12
24
62
450.57
mp-1040851
13.5789
6.775343
-5.865509
other
Zn4Sn8P8O36
56
62
856.74
mp-1195921
13.318547
5.509154
-6.074685
other
La8P12H12O36
68
62
892.14
mp-554906
12.250738
6.821047
-4.660889
other
Zn8Bi4P4O24
40
62
513.82
mp-759434
9.184785
9.896948
0.070339
other
Na40Mn8H8O32
88
62
1,270.87
mp-695866
9.764054
1.878747
-3.713808
other
Be4H32N8F16
60
62
517.15
mp-542295
8.411335
7.903799
-2.64833
other
Na4Yb4Ge4O16
28
62
410.77
mp-560026
13.848441
4.742273
-2.084184
other
Mg20B12O36F4
72
62
698.9
mp-555629
7.784087
2.357179
-1.229213
other
Sb4Te4Cl12F24
44
62
914.95
mp-1196133
1.966205
2.435617
-4.396779
other
U8P4Cl44O4
60
62
1,731.61
mp-756757
10.647279
1.202715
1.796964
other
Li4Mn8O4F12
28
62
358.22
mp-1195999
12.815857
5.859622
-6.133421
other
Cs8Cd4P8O28
48
62
965.28
mp-1196286
6.213315
5.040965
-4.518904
other
Rb12Ni8N28O84
132
62
1,816.02
mp-818685
7.573899
9.614578
-3.819081
other
Cr8Fe4N4O32
48
62
729.15
mp-555182
12.827767
6.341749
-0.674308
other
Na8Be8Si12O36
64
62
776.4
mp-765510
8.909131
8.16395
-5.022727
other
Li4Fe4P4O20
32
62
366.78
mp-1194597
10.821774
12.119605
-3.776977
other
Rb4Ta4V8O32
48
62
796.12
mp-758613
14.664484
7.998816
-5.536007
other
Li4V4P12O36
56
62
821.75
mp-697264
10.05045
5.811579
-4.025658
other
Cd4H8Se4O16
32
62
415.62
mp-541006
11.140168
11.855473
-3.012967
other
Ba4Tl4V4O16
28
62
512.9
mp-18006
-4.216758
-1.547015
-5.613797
other
Rb4Cu4Sn2S8
18
72
446.41
mp-1194598
13.50468
6.271925
-0.550691
other
Y4Mn2Si24O56
86
72
1,165.82
mp-1203058
9.004206
2.104041
-4.49114
other
H24C4N8O8
44
72
377.85
mp-849779
13.03829
6.430096
-0.811181
other
Li4Si24Bi4O56
88
72
1,179.16
mp-1180828
-2.562204
-0.739802
-5.399205
other
K8Eu2P4S16
30
72
807.05
mp-21510
-4.63161
-5.595385
0.404102
other
K4Na2In2As4
12
72
352.06
mp-17395
13.81185
4.359576
-2.254534
other
Tm2Cu2B10O20
34
72
341.93
mp-697721
8.402355
0.713085
-4.446769
other
H32C8N4Cl4
48
72
544.89
mp-17323
13.882253
4.350654
-2.27564
other
Tb2Cu2B10O20
34
72
349.23
mp-560226
13.125004
6.304191
-0.575703
other
Na4Nd4Si24O56
88
72
1,203.31
mp-863033
-4.303109
-2.678838
-3.495075
other
Rb8P4Pb2Se16
30
72
981.01
mp-1213705
-3.503262
-4.621763
0.715856
other
Cs4Na2Ga2P4
12
72
364.71
mp-6450
-3.428479
-4.418789
0.732768
other
K4Li2Al2P4
12
72
281.39
mp-1195151
10.94416
7.813828
3.051688
other
Ce20Zn10Se20O20
70
72
1,421.11
mp-557126
13.105589
6.30001
-0.600293
other
Na4Pr4Si24O56
88
72
1,214.3
mp-9676
-4.586863
-5.568085
0.404294
other
K4Na2Ga2As4
12
72
340.99
mp-18240
-4.272367
-1.504636
-5.683544
other
Tl4Cu4Sn2S8
18
72
424.16
mp-9068
-3.401947
-4.550466
0.771968
original
K4Na2Al2P4
12
72
302.3
mp-863392
12.560204
6.662026
-1.251354
other
Li4Fe4Si24O56
88
72
1,077.38
mp-1194232
-4.159902
-2.651378
-3.560052
other
K8Eu2P4Se16
30
72
921.29
mp-558121
-3.456182
-1.027967
-5.349769
other
K8Ba2V4S16
30
72
850.85
mp-561472
11.63493
7.677749
-4.22251
other
Hg8P4O12F4
28
72
530.07
mp-867516
7.565975
11.926776
2.094582
other
Ba4Tb4Mn8O22
38
72
493.45
mp-18595
13.878168
4.352014
-2.256271
other
Lu2Cu2B10O20
34
72
339.38
mp-9666
-3.426445
-4.556772
0.729538
other
K4Na2Ga2P4
12
72
304.72
mp-21511
-3.461108
-4.659367
0.731011
other
K4Na2In2P4
12
72
336.4
mp-9069
-4.607862
-5.480264
0.468391
other
K4Na2Al2As4
12
72
326.03
mp-557832
-4.127413
-1.595757
-5.448994
other
K4Cd2Au8S8
22
72
574.92
mp-1209478
10.068607
8.839978
0.254212
other
Rb4Li6Ga2O8
20
72
287.87
mp-1180288
8.751041
4.915432
-4.422268
other
Na4Hg6S8O4
22
72
483.15
mp-774422
13.483237
6.907529
-0.94986
other
Li4V4Si24O56
88
72
1,072.12
mp-555140
10.097422
8.566301
0.143906
other
Cs4Li6Ga2O8
20
72
309.86
mp-2216234
11.613782
12.258548
-2.815576
other
K4Mg1V6O16
27
75
469.22
mp-1105564
-6.376341
-3.793103
0.047029
other
Ni8Bi8S1I1
18
75
408.42
mp-1214892
8.354402
11.674354
0.294175
other
Ba4Cr8Ru16O48
76
75
944.2
mp-758470
11.454414
7.826928
-7.533773
other
Li2Fe4P10O32
48
7
686.91
mp-779046
14.084715
7.09618
-6.341767
other
Li10Cu2P4O16
32
7
330.75
mp-1223182
11.990343
11.102068
-3.027172
other
Li8Fe8Mo12O48
76
7
1,012.44
mp-758161
14.176258
8.40867
-6.837234
other
Li2V4P10O32
48
7
696.23
mp-1229272
-3.471366
-1.3557
-5.381378
other
Ag2Sb6Pb2S12
22
7
766.29
mp-1199592
4.458868
2.809515
-3.636498
other
Sb4C18N6Cl18
46
7
1,489
mp-1272533
7.151104
12.115496
1.815368
other
Ca2La2Mn4O12
20
7
233.05
mp-1147684
-2.400699
-0.545851
-5.659065
other
Li20Zn2P8S32
62
7
1,272.96
mp-1222447
12.851901
6.463332
-6.411385
other
Li2P10Pb4O30
46
7
685.76
mp-766087
9.817448
7.840201
-6.323089
other
Li4Ni4P8O28
44
7
543.47
mp-1311449
10.132473
0.385112
0.029577
other
Li8Co4O2F14
28
7
302.23
mp-764977
10.703777
0.857366
0.817293
other
Li8Fe4O4F12
28
7
299.96
mp-1179537
7.546037
6.933305
-4.606155
other
Te2P6N8O36
52
7
913.07
mp-543094
8.854842
7.96624
-4.948793
other
Li4Fe8P12O48
72
7
932.66
mp-779809
10.181398
4.607521
-6.937383
other
Li8Sb8S16O64
96
7
1,388.25
mp-760897
9.700497
11.326177
0.255764
other
K8Li14Mn4O16
42
7
543.56
mp-1218091
5.925071
11.509171
0.34773
other
Sr2Pr2Co4O12
20
7
230.2
mp-759751
10.958194
-0.074681
0.243363
other
Li4Mn12O4F32
52
7
672.94
mp-765358
10.169518
1.809852
1.140544
other
Li12V4O4F20
40
7
412.57
mp-753369
13.926029
8.679197
-0.840944
other
Li4V2Si2O8
16
7
177.22
mp-773049
12.220142
10.822289
2.343263
other
K6Li2Nb12O30
50
7
687.62
mp-1236920
-3.475124
-1.371716
-5.374276
other
Ag2Sb6Pb2S12
22
7
656.27
mp-1041103
12.675485
10.746462
0.250094
other
Ho2Mg2Mo4O12
20
7
242.02
mp-1346591
7.488738
10.771744
-0.237227
other
La2Ti2Cr2O12
18
7
223.6
mp-1277814
10.126549
0.556616
0.988918
other
Li20Ni4O4F20
48
7
531.65
mp-766426
10.203096
8.044183
-6.755539
other
Li4Co4P8O28
44
7
532.55
mp-766499
13.66302
5.463587
-2.839879
other
Li8Mn6B8O24
46
7
473.06
mp-26794
9.981646
7.697872
-6.19852
other
Li6Cu2P4O16
28
7
340.74
mp-1378182
6.211056
11.184833
-1.008802
other
La2Cr2Fe2O12
18
7
224.66