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-769967
12.903925
12.650242
-0.224899
other
Li6Nb2V6O16
30
12
321.13
mp-1205686
9.421654
9.730508
3.491429
other
Ba2Pr1Ta1O6
10
12
161.45
mp-26685
10.736668
7.912852
-6.988227
other
Li2Ni2P8O24
36
12
506.52
mp-755724
11.639163
13.53008
-0.739997
other
Li3V2Ni1O6
12
12
109.8
mp-756875
8.318047
12.983745
-0.571212
other
Li4Nb1Cu3O8
16
12
156.48
mp-759180
6.044661
13.020632
-1.738923
other
Li2Fe3Co1O8
14
12
148.6
mp-1174580
3.801047
23.425436
-1.29665
other
Li8Mn2Co4O14
28
12
253.12
mp-1178661
10.183017
10.578873
-3.761932
other
Yb2Mo2Cl2O8
14
12
273.56
mp-2218947
9.072328
14.240448
-1.11796
other
Mg1Mn3Te1O8
13
12
167.17
mp-1206068
-3.863697
-1.497213
-5.302065
other
In1Bi2S4Br1
8
12
204.52
mp-1196247
8.305099
10.520428
1.380869
other
Ba12Sm3Ru9O36
60
12
921.11
mp-22242
8.807738
1.559696
1.364715
other
Na1Zr2Fe1F11
15
12
227.12
mp-1278198
12.878139
12.326452
0.24674
other
Li8Ti4V4O16
32
12
302.87
mp-546561
10.789904
7.895389
2.99987
other
Nd2Cr2S4O2
10
12
173.29
mp-2224752
6.216908
13.457674
-2.109868
other
Mg1Fe1Co3O8
13
12
142.88
mp-755134
12.926212
12.136848
-0.153366
other
Li3V4Cr1O8
16
12
158.57
mp-554952
10.255035
8.890138
-1.835031
other
Te4Pb6Cl4O12
26
12
516.2
mp-768728
10.902926
13.524168
-0.043483
other
Li8Cr6Ga2O16
32
12
295.28
mp-2242052
8.514603
10.996847
-0.408609
other
Mg1Al2Cu4O8
15
12
154.68
mp-1221377
6.815788
6.169962
-3.959555
other
Na2V3Se6O6
17
12
353.14
mp-1221166
3.330004
-0.657853
-2.385963
other
Na4H8Pd1Pt1
14
12
190.65
mp-23637
10.864967
11.132831
-2.582649
other
V2Bi2Pb2O10
16
12
257.33
mp-24410
9.967226
3.006276
-4.029039
other
Co1H4Br2O2
9
12
130.33
mp-1207920
9.333648
11.514986
-3.803018
other
V2Cu3H2O9
16
12
225.87
mp-863763
-4.529371
-3.799253
-3.926528
other
K2Y4Cu4Se9
19
12
462.27
mp-1290930
9.925732
13.933788
-0.513113
other
Li8Cr6Ni2O16
32
12
291.04
mp-8500
7.885582
2.358125
-1.346862
other
As1S2N1F6
10
12
176.74
mp-643902
9.52586
1.709166
-3.90966
other
Sn1H4N2F2
9
12
87.95
mp-756976
8.062321
13.964655
-1.08577
other
Li3Cr2Ni2O8
15
12
142.42
mp-2232666
10.887484
13.107923
-3.369524
other
Mg1V4Ag2O11
18
12
228.02
mp-1101981
13.132463
5.79442
-6.894941
other
Sr1Ge1P2O8
12
12
145.4
mp-1280637
6.14776
12.941867
-1.460273
other
Li8Mg2Ni6O16
32
12
277.13
mp-1181548
-3.813267
-0.717533
-5.634033
other
Cu8W2S8Cl8
26
12
575.46
mp-2218878
9.676182
12.058927
-1.005798
other
Mg1Co2Sb2O8
13
12
166.78
mp-763910
8.07134
14.426605
-0.796462
other
Li4Mn1Fe3O8
16
12
152.06
mp-1100751
3.307909
23.195894
-1.543003
other
Li9Mn2Co5O16
32
12
294.3
mp-2232629
9.94113
12.560764
-0.606125
other
Mg1Fe4Ni2O8
15
12
154.68
mp-2232391
11.628591
10.851749
-1.965445
other
Mg1Tl4W2O8
15
12
334.12
mp-1084823
9.627319
9.974319
1.480935
other
Sr2Cr1Sb1O6
10
12
127.79
mp-1222632
9.886181
7.049597
-3.003469
other
Mg2Al2Si8O30
42
12
625.67
mp-1214813
10.355083
10.378563
1.580054
other
Ba2Lu1Re1O6
10
12
147.03
mp-754436
6.560788
13.054683
-0.902181
other
Li3Y1Ni2O6
12
12
120.93
mp-1175280
6.353608
20.304501
-0.448547
other
Li14Mn8Co2O24
48
12
437.74
mp-774353
7.884502
13.543823
-0.688066
other
Li6Ti2Ni4O12
24
12
218.1
mp-1174467
3.873071
23.327667
-1.276453
other
Li7Mn2Co3O12
24
12
215.6
mp-2232936
10.064528
12.690443
-0.563558
other
Mg1Zn2Fe4O8
15
12
166.02
mp-867832
9.046852
13.619148
-0.627618
other
Li6Ti1Fe5O12
24
12
224.37
mp-756607
10.684491
12.933228
-0.092825
other
Li3Mn4Sb1O8
16
12
176.55
mp-555949
7.27526
9.878079
0.450814
other
K2Eu2Pd2O6
12
12
194.68
mp-1228063
12.389666
7.306565
0.796108
other
Ba3Ti1Al10O20
34
12
434.56
mp-1174510
3.890674
23.324903
-1.246921
other
Li7Mn2Co3O12
24
12
217.55
mp-2218133
10.397576
9.486904
0.455827
other
Na5Mg1Sb1O5
12
12
171.51
mp-1172881
10.785734
7.782068
2.820996
other
La12Ti6Se18O10
46
12
979.66
mp-752543
12.84647
10.756765
1.316629
other
Li3Ti4V1O8
16
12
148.52
mp-569287
-3.988849
-2.386068
-3.686585
other
Tl2P2Au2Se6
12
12
335.65
mp-26771
14.253526
7.417212
-6.567427
other
Li8Cr4P8O28
48
12
571.64
mp-864432
8.900962
13.927355
-0.868443
other
Li6V1Fe5O12
24
12
223.71
mp-1176296
3.852672
23.07313
-1.336189
other
Li9Mn2Co5O16
32
12
287.93
mp-2219637
13.471876
8.50251
-0.827781
other
Mg1Ti2Si2O8
13
12
147.04
mp-1173976
5.44644
19.741379
-1.191446
other
Li3Mn1Co2O6
12
12
111.48
mp-1174186
7.340543
18.484385
-0.377586
other
Li4Mn3Co1O8
16
12
151.11
mp-1222453
8.247415
9.573643
2.348594
other
Li1La4Cu1O8
14
12
187.56
mp-1228435
5.99537
8.613526
-0.477754
other
Ba6Bi4Pb2O18
30
12
507.43
mp-768747
13.950777
5.411469
-2.089823
other
Li14Bi2B4O16
36
12
355.92
mp-1191023
10.328523
9.024071
-1.956362
other
Bi3Te4Cl5O10
22
12
429.71
mp-1211473
10.992819
11.295444
-2.070701
other
K2La2W4O16
24
12
360.12
mp-1197110
10.266818
4.309067
-6.591475
other
Rb12H4S8O32
56
12
863.01
mp-1208083
7.843694
10.273868
-3.716966
other
Tl1Cr2Fe1O8
12
12
205.56
mp-1228363
7.359623
9.336545
0.150969
other
Ba2Tl2Cu1O6
11
12
182.28
mp-1645230
6.847576
14.139161
-1.692498
other
Li8Ti2Co10O24
44
12
410.16
mp-1078872
1.526106
2.874529
-6.083486
other
Cs2Pu1Cl4O2
9
12
282.3
mp-1045829
6.727037
12.267749
-1.563222
other
Al1Cu3Ni4O12
20
12
184.95
mp-504158
14.435245
8.306165
-6.245489
other
Li8Mo2P4O18
32
12
365.59
mp-1177929
6.077052
13.518019
-2.021863
other
Li2Mg1Co3O8
14
12
138.81
mp-2218930
8.208132
10.511846
-3.321132
other
Mg1Cr2Cd2O8
13
12
186.63
mp-2229119
12.670836
12.086904
-1.219114
other
Mg1V4Zn2O10
17
12
218.16
mp-754904
12.993355
12.024291
0.074074
other
Li6Nb2V4O12
24
12
234.72
mp-567655
4.451559
2.22343
-3.095617
other
Sr2C1N2Cl2
7
12
152.08
mp-549737
13.210804
4.787785
-1.384401
other
Ba2Ca1B2O6
11
12
153.76
mp-549671
10.517001
11.263066
0.330204
original
K4Li4Mn4O8
20
12
283.74
mp-1228583
-6.07928
-2.115732
1.18074
other
Ba2Na1Fe6As6
15
12
295.38
mp-1303115
7.281135
14.102605
-1.061109
other
Li6Fe4Co2O12
24
12
221.76
mp-1214433
11.562024
7.197459
-4.317939
original
Ba1Ge1As2O8
12
12
180.18
mp-1175277
6.372296
20.33786
-0.438266
other
Li7Mn4Co1O12
24
12
217.86
mp-1103201
-4.099444
-3.502438
1.115001
other
Ce4P4Au2O2
12
12
236.88
mp-753424
8.471703
13.515213
-0.600467
other
Li3Ti2Ni2O8
15
12
145.72
mp-757424
7.96112
14.122669
-1.486894
other
Li1Mn3Ni1O8
13
12
146.15
mp-1216333
10.274089
10.007174
-3.469793
other
V2Ni6As2O16
26
12
286.68
mp-1193128
10.207591
8.925511
-1.821596
other
Te4Pb6Br4O12
26
12
540.92
mp-754256
9.689274
13.928746
-0.476307
other
Li4Cr2Fe2O8
16
12
149.62
mp-771024
10.074202
14.068547
0.271954
other
Li3Ti1Mn4O8
16
12
163.84
mp-1191505
9.055165
10.203556
-3.70916
other
U1Cu4Mo2O16
23
12
329.07
mp-756602
9.682002
14.409414
-0.198784
other
Li3Mn4Cr1O8
16
12
160.54
mp-1198584
11.020976
4.470749
-4.627888
other
Ni3P2H16O16
37
12
296.47
mp-1218633
9.988026
10.650498
3.334365
other
Sr3Nb2Cu1O9
15
12
203.12
mp-2219125
9.91958
12.620152
-3.572001
other
Mg1V2Cu2O8
13
12
160.86
mp-1218650
7.651505
11.398603
0.720626
other
Sr6Fe4Mo2O18
30
12
381.6
mp-2228510
6.179532
12.462874
-1.414896
other
Mg1Zn2Ni3O8
14
12
155.02
mp-1284552
8.359629
11.547072
2.352947
other
Sr4Ta2Mn2O12
20
12
260.38
mp-1246776
-4.831903
0.067147
-5.294299
other
Sm1Mg2W3S8
14
12
294.19