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-1194357
11.61007
5.6021
-2.744279
other
Nd2B8Cl2O16
28
9
346.71
mp-772069
14.7356
7.799126
-5.455891
other
Li2Fe2P2O8
14
9
187.91
mp-697753
13.285491
7.85123
-7.568064
other
Li6Cr4P6O24
40
9
464.69
mp-540482
11.564857
7.890534
-7.586514
other
Li2Cr2P4O14
22
9
321.82
mp-31603
11.101683
7.925629
-7.245786
other
Li2Co2P8O24
36
9
494.79
mp-1192457
8.281264
2.149489
-0.722829
other
Sb2Ir2Xe2F24
30
9
551.7
mp-758438
14.579091
12.702784
-2.504228
other
Li2V6O10F6
24
9
257.61
mp-767762
14.832793
5.381631
-2.551125
other
Li10Mn12B12O36
70
9
754.99
mp-754459
8.041137
2.591486
-1.362257
other
B2Cl2O4F8
16
9
231.02
mp-860940
10.659987
3.036093
1.891934
other
Li4V8O4F20
36
9
420.79
mp-1223669
12.742022
6.378955
-0.588619
other
K2Al6Si6O24
38
9
497.76
mp-1204619
11.676282
4.576974
-4.611716
other
K8P4H16O20
48
9
608.92
mp-554646
4.346218
3.008302
-3.977769
other
Te2S8N8Cl8
26
9
632.47
mp-1229254
11.169206
6.72269
-2.419215
other
B6Pb20Br6O26
58
9
1,206.26
mp-699482
10.525626
3.642349
-4.155134
other
Na4H40C2O26
72
9
645.84
mp-743715
9.536711
1.772241
-3.393387
other
Ti2H20N6F10
38
9
478.92
mp-766544
11.823246
7.212245
-2.094922
other
Li4Mn4Si6O20
34
9
429.3
mp-622093
8.529545
5.847148
-5.724257
other
K6Yb2S6O24
38
9
679.04
mp-1220919
13.0088
6.239439
-0.390777
other
Na2Al6Si6O22
36
9
496.34
mp-708034
9.869621
3.439457
-4.421909
other
H26Se4N6O16
52
9
602.72
mp-1301965
14.707042
7.699284
-5.48759
other
Li4Fe4P4O16
28
9
427.38
mp-1177035
12.725555
8.689332
-7.95296
other
Li12V6P16O58
92
9
1,171.29
mp-1221218
-4.765383
-5.517218
0.507617
other
Na8Eu4Sn2As8
22
9
615.07
mp-1214062
10.058519
7.136523
-2.175221
other
Ca2Al4Si6O24
36
9
558.61
mp-1209358
-3.365419
-0.815438
-4.886606
other
Rb6Ta4As2S22
34
9
950.44
mp-775180
8.186156
13.162843
-1.349367
other
Li4Co6W2O16
28
9
291.32
mp-759479
9.959889
7.827451
-3.041274
other
Li16Co16Si16O64
112
9
1,399.85
mp-1214520
7.65036
6.601342
-3.053706
other
Ba2Nb2I10O32
46
9
767.48
mp-761092
10.321675
13.154329
-3.501678
other
Li8V4O12F4
28
9
282.37
mp-556209
11.244926
11.159719
-3.616742
other
Rb2Li2Mo2O8
14
9
275.91
mp-1076630
12.086324
12.188812
-2.139217
other
K2Na14V16O40
72
9
899.55
mp-1210927
11.264832
11.098938
-3.583237
other
Na6Li2Mo4O16
28
9
488.06
mp-1220783
-3.479002
-4.602813
0.819378
other
Na10Sr2Nb2P8
22
9
549.51
mp-2715262
13.695372
5.326097
-7.18012
other
Na18Al12P18O72
120
9
1,367.17
mp-1214599
9.108288
2.109514
0.59468
other
Ba4Mo2O6F8
20
9
330.08
mp-26863
13.800557
8.566251
-6.591831
other
Li4Mo2P4O16
26
9
305.49
mp-771349
11.913108
11.285593
-1.745056
other
K2Li2W6O18
28
9
397.44
mp-1177126
11.986354
8.859947
-7.911479
other
Li10V6P16O58
90
9
1,166.04
mp-560386
-3.979485
-1.29383
-5.825289
other
In4Ag4Ge2S12
22
9
537.01
mp-1229098
-4.003836
-4.946195
0.590364
other
Cs6B2As2P2
12
9
474.58
mp-759617
14.887674
7.858203
-4.939972
other
Li10Fe8P8O32
58
9
718.14
mp-1224100
-4.864665
-6.235666
0.667407
other
K8Ba4Sn2Sb8
22
9
924.84
mp-766179
12.684844
6.466312
-0.978721
other
Li4Si12Bi4O32
52
9
701.31
mp-1046678
13.86831
7.974918
-6.414648
other
Zn2Cr2P2O10
16
9
188.67
mp-761120
11.314537
-0.350413
0.336223
other
Li4Mn8O4F20
36
9
408.29
mp-769550
8.517227
14.893582
-0.878869
other
Li4Mn10Fe4O24
42
9
466.32
mp-1046989
11.887979
10.561708
1.120313
other
Ca4Al2Mo2O10
18
9
243.14
mp-1225947
1.548762
2.405746
-3.514373
other
Hg4C6I10N2
22
9
1,049.35
mp-1191467
12.584581
6.031423
-6.442019
other
Cs4Cu2P4O14
24
9
465.5
mp-540133
10.157468
7.953362
-6.690835
other
Li2Co2P4O14
22
9
319.71
mp-1177017
9.97922
8.010976
-6.253138
other
Li12Fe6P16O58
92
9
1,202.5
mp-777383
14.096739
7.130005
-6.321993
other
Li4Cr2P8O24
38
9
520.57
mp-1176778
12.670004
7.557506
-7.349708
other
Li4Co4P4O16
28
9
350.46
mp-758176
11.264977
7.598386
-7.289608
other
Li6Cu6P6O24
42
9
461.85
mp-756081
13.715939
5.450704
-2.985523
other
Li4Co4B4O12
24
9
239.08
mp-1642784
13.128457
7.455404
-7.218252
other
Li8Co4P8O28
48
9
532.72
mp-772907
14.806775
7.787244
-5.487048
other
Li16Cr16P16O64
112
9
1,479.26
mp-1181300
8.589846
9.937838
-3.324811
other
Mg16Si2W18O98
134
9
2,317.09
mp-752464
8.679899
14.561491
-0.088925
other
Li8Mn4O8F4
24
9
223.29
mp-1220796
-4.611323
-5.394322
0.493357
other
Na10Sr2Nb2As8
22
9
604.49
mp-1306478
11.191582
12.828609
0.400101
other
Li8Ti4Fe4O16
32
9
309.02
mp-1221028
8.5487
9.769315
1.991803
other
Na2Nd6Pt2O14
24
9
338
mp-1176902
12.734591
8.705975
-7.927924
other
Li12V6P16O58
92
9
1,163.68
mp-542545
-4.461802
-2.131768
-3.299384
other
K6Nb4As2Se22
34
9
1,016.01
mp-757380
13.429219
8.543941
-7.79465
other
Li14V6P16O58
94
9
1,168.27
mp-1224664
10.206229
3.010913
-4.635381
other
H26S4N6O16
52
9
474.96
mp-759735
12.783921
6.729601
-6.73169
other
Li4Bi2P10O30
46
9
619.31
mp-1220860
-4.662991
-5.424374
0.449811
other
Na10Eu2Ta2As8
22
9
596.52
mp-1249301
13.043761
6.726367
-1.11477
other
Li4V2Si12O30
48
9
665.23
mp-697645
10.156172
3.258551
-4.500905
other
H26Se4N6O16
52
9
510.63
mp-1198214
2.970066
2.578328
-4.708932
other
As12H12C6Cl24
54
9
1,359.81
mp-32352
10.825108
7.921906
-7.083512
other
Li2Ni2P8O24
36
9
487.01
mp-1176325
14.424086
7.443841
-5.584524
other
Na12Fe6P8O32
58
9
741.83
mp-6215
-3.523016
-1.261177
-5.670593
other
Ag2Hg2As2S6
12
9
272.77
mp-1221287
14.50297
4.72009
-7.214496
other
Na6Sc4P6O24
40
9
538
mp-1228771
8.723497
11.262688
0.000725
other
Ba2Fe10Bi8O30
50
9
647.06
mp-849678
10.156837
2.184484
2.236012
other
Li8Fe16O4F32
60
9
745.5
mp-1216804
10.971179
12.086535
-3.432743
other
Tl2V6Cd8O24
40
9
570.16
mp-1202436
8.126098
0.822975
-4.408942
other
H28C6N2Cl10
46
9
644.3
mp-560167
10.776248
12.174191
-3.540891
other
K2V6Cd8O24
40
9
590.85
mp-849793
13.75357
8.459
-0.95842
other
Li16V16Si16O64
112
9
1,467.27
mp-1222399
12.545425
10.874642
1.86092
other
Li2Nb2O4F2
10
9
116.51
mp-1293053
10.889833
7.69143
-2.805232
other
Mg4Mn4Si4O20
32
9
335.43
mp-662241
-4.713294
-2.707921
-3.484907
other
Rb4Nb2Ag2Se8
16
9
551.3
mp-561527
-2.487658
-0.492872
-5.305099
other
Rb6Zr4P10S36
56
9
1,590.92
mp-1303812
12.523465
13.157726
-0.957079
other
Li4V6Sn2O16
28
9
314.05
mp-1251079
10.758892
8.443984
0.972361
other
Ca4Al2Bi2O10
18
9
265.75
mp-2713373
11.773598
4.239232
-8.267734
other
Si6Ge12S12O72
102
9
1,330.99
mp-765430
11.356082
8.935565
-7.75501
other
Li8V6P16O58
88
9
1,170.57
mp-861623
12.174242
7.617443
-6.996652
other
Li2Ni8P6O24
40
9
417.99
mp-764928
14.449189
8.46525
-6.728416
other
Li4V4P8O28
44
9
486.26
mp-1195158
13.023721
6.182976
-0.386007
other
Ca2Al4Si6O20
32
9
480.07
mp-757988
13.395289
7.663204
-0.786825
other
Li16Fe4Si8O28
56
9
594.42
mp-1192826
10.296579
4.259575
-4.799362
other
Cu2H12S2O14
30
9
274.19
mp-694534
10.73622
8.033386
-7.322509
other
Li2Fe2P4O14
22
9
318.33
mp-1176787
10.072132
7.991935
-6.623981
other
Li2Co2P4O14
22
9
299.94
mp-1190145
-3.587607
-1.329384
-5.704186
other
Na4In4Ge2S12
22
9
581.99
mp-558219
-2.806228
-0.920863
-5.435779
other
Sr2Li2B6S12
22
9
475.84
mp-1191903
-3.649035
-1.37651
-5.858721
other
Li4In4Si2S12
22
9
501.74
mp-1641121
11.741985
12.491871
0.169418
other
Li4Ti2Fe4O10
20
9
189.57