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-753505
7.873375
13.029668
-1.110527
other
Li4Ti4Co4O16
28
95
291.91
mp-758596
11.530341
7.83247
-2.302711
other
Li4Fe4Si4O16
28
95
264.98
mp-754281
8.34179
13.552059
-1.230181
other
Li4Cr4Fe4O16
28
95
289.52
mp-776319
10.437757
12.602535
1.38241
other
Li4Nb4Cu4O16
28
95
328.55
mp-1202769
14.00809
3.839138
-7.518917
other
Rb16Nb16Si16O88
136
95
2,196.49
mp-758617
9.964106
8.370131
-2.971184
other
Li4Co4Si4O16
28
95
260.11
mp-18037
10.767445
12.024692
2.22297
other
Li4Nb4Zn4O16
28
95
323.99
mp-771821
10.784815
12.736107
0.748813
other
Li4Nb4Co4O16
28
95
321.77
mp-757050
6.312775
13.3882
-1.909235
other
Li4Fe4Co4O16
28
95
278.47
mp-761817
12.75036
11.640978
0.669308
other
Li4Nb4V4O16
28
95
333.55
mp-766083
13.895062
8.712407
-1.15176
other
Li4V4Si4O16
28
95
269.32
mp-771962
12.145949
11.872139
1.304115
other
Li4Nb4Cr4O16
28
95
336.84
mp-1176598
8.515658
14.069939
-0.816685
other
Li4Mn4Sn4O16
28
95
326.32
mp-1176679
8.900698
12.887775
-0.720877
other
Li4Fe4Sn4O16
28
95
323.63
mp-780087
11.520055
7.642436
-2.343185
other
Li4Mn4Si4O16
28
95
269.25
mp-770387
7.764693
14.022529
-0.766942
other
Li4Mn4Al4O16
28
95
266.08
mp-756415
11.835536
12.275146
1.011626
other
Li4Nb4Fe4O16
28
95
332.4
mp-770414
11.299505
13.481386
-1.54268
other
Li4Al4V4O16
28
95
275.61
mp-757813
9.844811
12.052539
-0.956753
other
Li4Co4Sb4O16
28
95
323.46
mp-756289
7.869433
14.13272
-1.090698
other
Li4Mn4Fe4O16
28
95
286.5
mp-775811
10.700084
13.219028
-1.711252
other
Li4V4Fe4O16
28
95
294.88
mp-758081
7.838356
13.095955
-1.144239
other
Li4Co4Sn4O16
28
95
318.79
mp-774473
9.858501
12.878209
1.091375
other
Li4Nb4Cu4O16
28
95
318.95
mp-1203188
8.771952
1.778997
-0.560723
other
Ca8As4H16F52
80
95
950.66
mp-757842
10.120313
12.893301
-2.649653
other
Li4V4Co4O16
28
95
294.1
mp-754807
11.018162
11.751214
-0.248746
other
Li4Fe4Sb4O16
28
95
332.06
mp-773989
8.854139
13.33976
-0.431641
other
Li4Ti4Fe4O16
28
95
299.11
mp-771705
11.442248
12.786772
1.069012
other
Li4Mn4Nb4O16
28
95
341.09
mp-777650
10.615648
12.466344
0.367305
other
Li4Nb4Ni4O16
28
95
316.13
mp-775311
9.151297
12.028934
-1.125076
other
Li4Cu4Sb4O16
28
95
320.51
mp-773600
12.269895
12.819394
-0.9215
other
Li4V4Sn4O16
28
95
324.39
mp-758241
13.025479
8.16869
-1.257168
other
Li4Cr4Si4O16
28
95
261.42
mp-777452
10.877855
12.715406
1.161008
other
Li4Nb4Co4O16
28
95
323.38
mp-774782
8.97415
14.124703
-0.200336
other
Li4Ti4Mn4O16
28
95
287.68
mp-771892
11.870676
12.286331
0.812515
other
Li4Nb4Fe4O16
28
95
331.47
mp-772390
6.248197
11.004428
-1.509907
other
Li4Al4Fe4O16
28
95
274.86
mp-774243
10.319158
13.341768
-0.59475
other
Li4Cr4Sn4O16
28
95
317.91
mp-757661
12.614102
7.318689
-7.403245
other
Li4Ni4P4O16
28
95
255.51
mp-861271
11.57096
12.654313
0.901624
other
Li4Mn4Nb4O16
28
95
338.23
mp-1176566
13.572488
8.414262
-0.663117
other
Li4Ti4Si4O16
28
95
268.36
mp-775214
9.91058
12.961436
-3.276517
other
Li4V4Cu4O16
28
95
289.67
mp-1180434
10.511882
3.405344
-4.008517
other
Na8H72S4O36
120
95
1,132.7
mp-755701
10.529483
12.215115
-0.260031
other
Li4Mn4Sb4O16
28
95
341.55
mp-755347
9.931145
10.863168
-1.658042
other
Li4Cu4Te4O16
28
95
330.35
mp-1203279
-2.692902
-2.565179
-5.74832
other
Pr32In8Sb8S72
120
96
2,980.31
mp-695985
10.320583
4.10726
-4.394928
other
Ni4H48S4O40
96
96
849.45
mp-1199091
13.69787
4.215659
-2.529597
other
Li12B20H8O40
80
96
707.96
mp-775461
11.797049
13.565332
-1.391644
other
Li8V12Fe4O32
56
96
604.67
mp-1201410
8.082019
2.022819
-0.470503
other
Sb16Au4Xe16F88
124
96
2,807.44
mp-1177856
12.607088
13.471356
-0.721916
other
Li8Ti4V12O32
56
96
606.33
mp-774276
10.259068
13.86757
-0.595497
other
Li8Cr12Sn4O32
56
96
623.35
mp-774837
5.94486
12.608371
-1.629728
other
Li8Fe12Ni4O32
56
96
531.07
mp-1177916
9.838125
14.081344
-0.836603
other
Li8Mn4Cr12O32
56
96
585.76
mp-1200653
7.901019
0.40886
-4.489542
other
Sn12H72C24S12
120
96
1,884.56
mp-1178042
6.048399
13.302643
-1.678731
other
Li8Co4Ni12O32
56
96
528.48
mp-760774
6.356127
13.255166
-1.419284
other
Li8Ni12Sn4O32
56
96
576.08
mp-774164
12.525469
13.22827
-0.841509
other
Li8V12Sn4O32
56
96
637.84
mp-1196183
-2.7753
-2.521804
-5.695134
other
Sm32In8Sb8S72
120
96
2,855.08
mp-775679
8.796151
14.671901
-1.031898
other
Li8Mn12Cr4O32
56
96
586.64
mp-1197684
11.131294
4.309729
-3.877866
other
Na20Al4H32O32
88
96
865.28
mp-1196911
10.17041
4.691693
-6.994973
other
Mn4Pb4S8O32
48
96
658.08
mp-1201452
-2.745068
-2.56658
-5.771246
other
Nd32In8Sb8S72
120
96
2,930.62
mp-1177874
7.578429
12.996434
-1.369595
other
Li8Ni12W4O32
56
96
598.39
mp-559696
12.399349
8.701167
-5.79372
other
Rb12Mo16P16O88
132
96
2,064.74
mp-560511
8.566703
3.278131
-5.736934
other
Ca4H8C8O16
36
96
450.14
mp-777396
8.296503
14.850528
-0.988604
other
Li8Mn12Fe4O32
56
96
593.47
mp-761082
11.148611
13.080899
0.142182
other
Li20Mn4Cr12O32
68
96
632.82
mp-1195014
7.883939
2.778106
-2.320687
other
Ge4C16Br8F40
68
96
1,253.19
mp-774798
8.693423
15.053508
-0.639708
other
Li8Mn12Sn4O32
56
96
635.66
mp-762142
6.118063
13.172353
-1.650075
other
Li8Fe12Co4O32
56
96
587.22
mp-887127
11.608703
13.712164
-1.561647
other
Li8V12Cu4O32
56
96
595.49
mp-555528
13.095005
6.318709
-0.514969
other
Ca2Th1Si8O20
31
97
431.29
mp-1209940
9.093008
0.755207
0.641985
other
Na1Sm1Cu2F8
12
97
158.15
mp-1209951
9.122557
0.829275
-0.218438
other
Na1Yb1Cu2F8
12
97
149.15
mp-2227469
-4.185357
-1.211014
-5.275895
other
Ba1Mg1Fe2S4
8
97
167.25
mp-1215855
-5.432107
-3.508607
2.922862
other
Zr10Ni1Sn1Sb4
16
97
347.85
mp-1104849
7.493685
6.388515
-2.90935
other
Sr1Ag2I4O8
15
97
305.4
mp-1218470
-8.037763
-2.507985
2.513216
other
Sr1Ca1Ni8Sn4
14
97
238.35
mp-1179111
7.46439
6.404914
-2.935706
other
Sr1Ag2I4O8
15
97
313.01
mp-1210237
9.241554
0.650732
0.231226
other
Na1Eu1Cu2F8
12
97
157.81
mp-1223353
-8.301613
-6.26395
2.206283
other
K1Rb1In4Au8
14
97
344.6
mp-1210068
9.10212
0.699419
0.760149
other
Na1Er1Cu2F8
12
97
151.95
mp-1210079
9.119077
0.773946
0.59854
other
Na1Gd1Cu2F8
12
97
156.39
mp-1211982
1.007095
2.031756
-3.998889
other
Lu4Nb24Cl52O12
92
98
2,356.5
mp-1203289
11.065172
8.051824
-1.853458
other
Cs16Ge16Sb16O80
128
98
2,208.82
mp-667315
1.051089
2.063618
-3.975688
other
Sc4Nb24Cl52O12
92
98
2,267.47
mp-1217806
11.1537
7.95892
1.11337
other
Tb8Gd4Ga20O48
80
98
968.47
mp-662606
-0.590345
0.731044
-3.741
other
Lu4Ta24Br52O12
92
98
2,501.77
mp-1210395
1.013954
2.062246
-4.020997
other
Sm4Nb24Cl52O12
92
98
2,486.29
mp-1217722
11.126822
7.958486
1.076561
other
Tb4Gd8Ga20O48
80
98
973.62
mp-1209869
-0.570155
0.741525
-3.744587
other
Sm4Ta24Br52O12
92
98
2,656.94
mp-1031292
16.50036
9.401568
7.616056
other
K1Na1Mg6O7
15
99
180.03
mp-1099225
16.234671
9.471562
5.997436
other
Cs1Mg6B1O7
15
99
200.25
mp-1219131
-5.624249
-1.770692
4.505853
other
Re2Si8Mo1W1
12
99
162.03
mp-1225915
-7.563639
-4.556919
5.616192
other
La2Al6Cu1Au1
10
99
204.89
mp-1077787
1.599255
2.576503
-3.513881
other
Pb1C1I3N1
6
99
250.27
mp-1218408
6.914895
11.892747
1.65172
other
Sr2Ca6Mn4O16
28
99
344.88
mp-1221640
-8.787615
-4.210436
2.782268
other
Mn1Al1Cu1Pd1
4
99
56.02
mp-1039826
17.627571
9.772341
7.669683
other
Rb1Na1Mg30O31
63
99
649.94
mp-1031259
16.468624
9.555162
7.130588
other
Cs1K1Mg6O7
15
99
200.53