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-770727
8.958565
13.022575
-0.62685
other
Li12Al8Fe4O24
48
12
418.52
mp-1643524
6.397581
20.238682
-0.445489
other
Li14Mn8Co2O24
48
12
430.84
mp-1212190
11.360006
7.827997
-1.294837
other
Ho2Fe2Ge4O14
22
12
280.47
mp-1173988
6.993391
18.84301
-0.508123
other
Li3Mn2Co1O6
12
12
114.26
mp-2215838
7.971663
11.676921
2.004724
other
Ba2Mg1Mn2O6
11
12
167.25
mp-568385
2.151927
2.007352
1.532416
other
Sr6Li6Ga6N12
30
12
400.73
mp-763114
8.236822
14.340822
-1.144572
other
Li3Cr2Co2O8
15
12
146.91
mp-1193864
12.301089
4.959427
-5.313635
other
Al4P2H6O14
26
12
257.64
mp-759243
13.862651
13.126015
-0.83655
other
Li6V4O8F4
22
12
224.45
mp-1192196
-4.177891
-3.272813
-4.316646
other
Ba7In2Se6F8
23
12
581.91
mp-556108
10.690434
10.36819
3.031109
other
Dy2Ti2Cl2O6
12
12
183.05
mp-1226140
8.935027
0.389148
0.633346
other
Cs6Tl2Ni6F20
34
12
620.05
mp-2215910
10.019034
12.653887
-0.529893
other
Mg1Zn2Fe4O8
15
12
167.07
mp-1180594
8.355206
7.168271
-4.118591
other
Na2Np2Se2O12
18
12
350.57
mp-1216705
11.947768
13.277196
-1.278705
other
V4Cu6Ni2O12
24
12
277.22
mp-756410
8.467813
15.086003
-0.734662
other
Li4Mn5Fe1O12
22
12
238.35
mp-696845
10.222454
3.16786
-3.846853
other
Mg1H12Cl2O6
21
12
216.25
mp-754101
8.825809
12.011869
-0.091916
other
Rb1Li7Ni2O6
16
12
186.73
mp-2224159
10.065849
10.412097
0.588012
other
Na1Mg1Co1O2
5
12
84.25
mp-556820
12.160679
6.851407
0.244756
other
Sm6Si4Cl10O12
32
12
667.1
mp-1207650
9.798415
11.069253
-2.957374
other
Yb2Ag2W4O16
24
12
317.83
mp-753140
10.066781
13.474505
0.002547
other
Li3Ti2Fe2O8
15
12
151.99
mp-2229747
12.12475
11.489111
1.979051
other
Mg1Ti4Cd2O10
17
12
231.97
mp-1177566
12.919408
11.077976
1.525503
other
Li3Ti2Nb1O6
12
12
113.5
mp-1234955
12.987247
11.319655
0.283664
other
Ca1Al2V4O8
15
12
165.23
mp-763184
9.434137
14.287176
-0.822623
other
Li3Cr3Co1O8
15
12
143.12
mp-1080045
9.888529
3.67641
-3.627437
other
Sr2H2Br2O2
8
12
171.16
mp-756070
6.026065
13.189556
-1.533913
other
Li4Co1Ni5O12
22
12
213.01
mp-1105938
-3.345201
-2.223015
-5.755695
other
K2Dy4Cu4S9
19
12
407.83
mp-974451
12.210988
7.08319
1.065606
other
K4Al4O6F4
18
12
291.81
mp-2218426
13.004252
7.757836
-6.679092
other
Mg1Co2P2O8
13
12
149.05
mp-1273630
12.109876
12.668777
0.597245
other
Li8Ti4Cr4O16
32
12
301.14
mp-774897
9.323201
14.871836
-0.196705
other
Li6Mn4Cr2O12
24
12
225.79
mp-753249
13.316977
8.961705
-7.446287
other
Li2V2P2O10
16
12
222.74
mp-1191037
8.165612
2.091204
-1.081984
other
Ag2As2Se6F12
22
12
412.95
mp-1228526
8.660867
12.31164
-0.802168
other
Ba3Fe10Sn1O20
34
12
492.99
mp-1246376
-4.8006
0.056007
-5.202434
other
La1Mg2W3S8
14
12
297.72
mp-554140
-5.254683
0.191814
-5.13747
other
Tl1V3Cr2S8
14
12
248.55
mp-756824
11.145452
13.093255
-0.450123
other
Li3V1Fe4O8
16
12
151.46
mp-13510
-7.491045
-4.081082
5.443373
other
Ho4In1Ni2Ge4
11
12
213.51
mp-1174572
3.283496
23.082352
-1.496057
other
Li7Mn2Co3O12
24
12
223.16
mp-1227175
9.881745
10.742006
2.208237
other
Ca2Nd2Cr2O8
14
12
182.66
mp-570644
-4.638915
-7.154198
2.884068
other
Ba14Na21Ca1N6
42
12
1,691.49
mp-1105260
-7.316936
-4.300649
5.606171
other
Tb8In2Ge8Rh2
20
12
438.11
mp-1235156
6.302154
11.276202
-0.250857
other
Ba2Li1Ni2O6
11
12
146.88
mp-2215804
10.063647
12.727
-0.541266
other
Mg1Zn2Fe4O8
15
12
158.63
mp-1213174
11.609422
11.202882
-2.591958
other
Cs1Sc1W2O8
12
12
254.71
mp-772083
9.48643
13.034563
-0.512314
other
Li3Nb1Co4O8
16
12
156.93
mp-2224746
-5.414417
-0.693797
-4.520572
other
Mg1Zn2Co4S8
15
12
231.84
mp-1177503
10.300527
13.776324
-0.317003
other
Li4Cr3Fe1O8
16
12
147.73
mp-1174140
5.639022
18.872814
-1.30689
other
Li4Mn1Co3O8
16
12
147.5
mp-2220058
8.839166
14.719441
-0.666838
other
Mg1Mn3Sn1O8
13
12
166.7
mp-1218672
6.840073
12.015725
1.698334
other
Sr4Ce1Mn5O15
25
12
294.56
mp-2227974
9.524406
13.972886
-0.181781
other
Mg1Mn4Zn2O8
15
12
177.37
mp-2218764
6.663035
13.212506
-1.859966
other
Mg1Co3Bi1O8
13
12
166.33
mp-1191227
2.979107
3.103453
-4.090004
other
Re1Ir2N10Cl10
23
12
591.34
mp-821363
9.291718
0.727041
0.444189
other
Ba7Fe6O2F32
47
12
753.15
mp-769962
9.350097
13.681031
-0.326179
other
Li4Ti1Fe3O8
16
12
152
mp-559292
8.175516
2.081564
-0.730287
other
P6Pb3Xe11F58
78
12
1,445.17
mp-1100753
3.252714
23.333616
-1.554076
other
Li9Mn2Co5O16
32
12
291.33
mp-1212518
10.540408
10.481837
3.024126
other
Gd2Ti2Cl2O6
12
12
183.2
mp-752523
5.855954
12.934964
-1.619773
other
Li4Fe2Ni6O16
28
12
280.4
mp-2218766
8.987016
14.491934
-1.268617
other
Mg1Mn3V1O8
13
12
155.37
mp-1280664
12.137918
12.588397
0.59794
other
Li8Ti4Cr4O16
32
12
305.04
mp-777449
12.704038
12.95824
-0.649436
other
Li4V5Sn1O12
22
12
245.62
mp-1100740
3.811312
23.212811
-1.340649
other
Li9Mn2Co5O16
32
12
291.92
mp-1025316
-5.473623
-1.648128
5.575743
other
Ho2Fe2Si2C1
7
12
105.12
mp-1104583
7.835696
7.025933
-4.565559
other
Pt1S2N4O8
15
12
237.8
mp-558831
8.240158
9.877514
1.47675
other
K2Nd2Pd2O6
12
12
194.41
mp-1202382
5.827024
3.407491
-4.764069
other
Mn4Fe2C28O28
62
12
1,088.9
mp-2228656
9.366021
14.222582
-0.500264
other
Mg1Mn4Cu2O8
15
12
169.59
mp-1280554
8.812655
14.883946
-0.083237
other
Li8Mn4O8F4
24
12
223.23
mp-1304327
8.50352
14.999129
-0.761202
other
Li2Mn3Ga1O8
14
12
146.76
mp-632759
10.383025
2.68678
-2.975352
other
Cu1H4O2F2
9
12
78.93
mp-754504
8.724121
14.341757
-1.320966
other
Li1Mn3Cr1O8
13
12
151.05
mp-2232677
9.795325
12.777334
-0.669563
other
Mg1Fe4Co2O8
15
12
165.31
mp-2219583
12.741169
11.516781
0.882625
other
Mg1Nb2V2O8
13
12
150.08
mp-772309
8.186202
12.518799
-0.578652
other
Li3Ti1Cu4O8
16
12
155.33
mp-756266
10.881873
13.544173
-0.045914
other
Li8Cr6Ga2O16
32
12
296.09
mp-1213858
10.949476
4.546316
-4.435984
other
Co3As2H16O16
37
12
321.02
mp-756524
11.212589
13.354892
0.030591
other
Li8Nb2Cr10O24
44
12
490.46
mp-567556
-4.239145
-2.282566
-4.037699
other
Cd2Sb4Se6Br4
16
12
488.68
mp-1216438
10.3885
9.550518
-3.418778
other
V2Co6As2O16
26
12
280.76
mp-540356
12.084686
7.592854
-7.476174
other
Li2Fe2P8O24
36
12
533.96
mp-1025205
-4.862657
-1.61188
4.500665
other
Y2Re2Si2C1
7
12
120.94
mp-7744
9.881021
4.372672
-6.656159
other
Li2S2O6F2
12
12
175.66
mp-669455
-0.454137
1.391123
-4.295971
other
Ga4Hg11As4Br16
35
12
1,247.66
mp-2226873
6.883864
13.73031
-2.030736
other
Mg1Cr1Co3O8
13
12
139.3
mp-755147
11.699967
13.025757
0.435645
other
Li3Ti1Cr2O6
12
12
111.49
mp-1210086
10.92598
4.314689
-7.5018
other
Na1Ga1S2O8
12
12
150.52
mp-2229227
12.668371
6.852092
-3.681475
other
Mg1Fe4H4O8
17
12
183.65
mp-1235592
11.339738
11.653092
0.32009
other
Li1Y2Fe4O8
15
12
185.3
mp-554410
7.919182
10.233253
1.654775
other
Ba2La1Ru1O6
10
12
161.32
mp-756302
8.011592
14.16869
-1.1221
other
Li3Mn1Co4O8
16
12
148.92
mp-753978
5.766656
12.701408
-1.689476
other
Li2Fe1Ni3O8
14
12
141.22
mp-865762
2.348327
2.497838
-4.432372
other
Tl1W2Cl6O2
11
12
282.67
mp-1080695
8.12553
4.001309
-6.255621
other
K1Np1C2O6
10
12
178.87
mp-1176275
4.036983
22.738245
-1.316998
other
Li9Mn2Co5O16
32
12
285.09
mp-1217720
9.740988
10.806395
0.163312
other
Tb2Mn3Sb3O14
22
12
275.43
mp-1213735
-1.072846
1.211959
-1.707733
other
Cs2La10Ru2I17
31
12
1,368.53