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-1174416
4.730423
21.971626
-0.890361
other
Li6Mn3Co1O10
20
8
188.87
mp-1233258
9.80568
12.417608
1.194079
other
Mg1Ti4Cu3O12
20
8
206.86
mp-1246416
-4.850432
-0.352599
-5.448673
other
Zr2Cr2Ag2S8
14
8
285.01
mp-764872
10.247669
2.113091
2.28497
other
Li5Fe7O3F13
28
8
339.86
mp-2228878
6.833882
13.822959
-1.971362
other
Mg1Mn2Co4O12
19
8
217.7
mp-557343
12.81284
5.494736
-5.687863
other
Zn6B2P2O14
24
8
274.92
mp-1100666
3.876998
23.05187
-1.335039
other
Li9Mn2Co5O16
32
8
289.93
mp-2226888
2.167654
2.496685
-4.516401
other
Mg1W1Cl4O1
7
8
183.83
mp-867996
10.205384
7.329166
-5.04271
other
Rb2U5P4O28
39
8
731.74
mp-1235552
10.9105
8.35329
2.178249
other
Sr1Li1Al1O3
6
8
66.19
mp-850986
10.447032
0.521462
-0.23933
other
Li6Co6O5F11
28
8
308.47
mp-2229272
10.80711
12.950169
-0.097975
other
Mg1Ti2Fe4O10
17
8
208.03
mp-2217792
-3.387999
-1.03102
-5.339766
other
Ba2Mg1V2S6
11
8
257.72
mp-2239906
-5.975712
2.082253
-5.093422
other
Mg1Mo1W2S6
10
8
256.59
mp-2232652
10.243508
12.694963
-0.533334
other
Mg1Zn2Fe4O8
15
8
164.51
mp-1221912
-4.851275
-0.900796
-5.749124
other
Mn2Cr1Ga3S8
14
8
296.83
mp-1175006
3.588344
23.56086
-1.344813
other
Li7Mn2Co3O12
24
8
218.76
mp-1220815
8.857481
1.695796
1.441363
other
Na1Hf2Ti1F11
15
8
223.76
mp-1100671
3.961883
22.921251
-1.326034
other
Li9Mn2Co5O16
32
8
288.31
mp-2210626
8.806833
2.254129
0.755777
other
Mg1Sb1O1F3
6
8
100.92
mp-2228725
9.013027
14.869011
-0.744455
other
Mg1Mn4Cu2O8
15
8
188.48
mp-2219990
11.733972
9.855371
2.387274
other
Sr3Mg1Ti2O7
13
8
182.96
mp-2242240
6.630105
12.81531
-1.600987
other
Mg1Co1Ni4O8
14
8
146.46
mp-2218486
9.643891
8.888262
0.394035
other
Na4Mg1Bi2O6
13
8
185.28
mp-756438
8.173415
12.896755
-1.749967
other
Mn3Ni3Te2O16
24
8
273
mp-753840
8.905273
15.262539
-0.634732
other
Li4Mn8O13F3
28
8
306.51
mp-766810
6.567228
13.660841
-1.980733
other
Li1Co2Cu1O6
10
8
102.63
mp-771209
9.485442
12.757883
-1.794876
other
Li7Cr3W2O16
28
8
292.37
mp-18012
12.83075
7.498258
-6.905557
other
Na4Co7P6O24
41
8
486.56
mp-1175051
3.317611
23.117455
-1.477589
other
Li7Mn2Co3O12
24
8
223.12
mp-772971
8.933377
14.639814
-0.260859
other
Li4Ti3Mn5O16
28
8
295.71
mp-2240424
8.672806
10.791232
-0.012582
other
K2Mg1Co2O4
9
8
149.25
mp-1221037
6.063848
5.180598
-4.478359
other
Na1Rh1N8O12
22
8
312.09
mp-2227802
11.812642
9.745193
2.10102
other
Sr2Mg1Ti1O4
8
8
128.78
mp-2225353
12.649619
11.802997
-1.331913
other
Mg1V1Mo1O5
8
8
99.52
mp-2226551
12.49181
9.997801
1.711205
other
Na2Mg1Ti1O3
7
8
91.81
mp-1235030
11.325256
9.05017
2.463567
other
Li1Eu1Y1O2
5
8
89.78
mp-2226986
-4.111533
-0.183996
-4.148561
other
Mg1Nb2Pd1S6
10
8
212.1
mp-2231228
7.56446
12.806476
-1.822172
other
Mg1Co4Sb2O12
19
8
249.63
mp-1225594
6.662326
5.147133
-4.700651
other
La1Pb1N1O5
8
8
130.57
mp-1174479
3.616978
23.61322
-1.357888
other
Li8Mn2Co4O14
28
8
254.9
mp-1216853
-3.344859
1.673427
2.759554
other
Tm2Si9B36C1
48
8
485.96
mp-2229779
11.372806
10.187586
2.601241
other
Sr4Mg1Ti3O10
18
8
274.67
mp-1223574
9.103124
10.977696
-0.275833
other
K1Fe1Sn3O8
13
8
179.24
mp-2217172
12.040657
12.499708
-2.26302
other
Mg1V2Cd1O6
10
8
142.66
mp-1100679
6.71438
16.617571
-1.193466
other
Li9Mn2Co5O16
32
8
256.1
mp-2240693
10.159638
12.903958
-0.510963
other
Mg1Fe2Ag2O4
9
8
119.82
mp-2229394
8.545624
13.164378
0.524386
other
Mg1Sc2Mn4O10
17
8
205.34
mp-1274913
6.936287
11.134194
1.391371
other
Sr4Y4Co4O16
28
8
357.02
mp-2223659
7.373323
13.761815
-1.72477
other
Mg1Cr1Co2O6
10
8
107.91
mp-1306750
7.052708
13.538182
-1.977855
other
Li2Co10O14F2
28
8
283.75
mp-2226513
11.381775
10.79015
0.206755
other
Ba3Mg1V2O8
14
8
243.98
mp-2219947
7.179608
13.091761
-1.654346
other
Mg1Fe4O7F1
13
8
159.05
mp-1100656
6.582276
16.757772
-1.246376
other
Li9Mn2Co5O16
32
8
257.83
mp-1175304
5.935825
20.835464
-0.483517
other
Li7Mn4Co1O12
24
8
221.96
mp-2215845
6.697162
11.065745
0.15849
other
Ba2Mg1Ni2O6
11
8
157.63
mp-2225564
-5.978955
1.669793
-4.684588
other
Mg1Mo2Se2S2
7
8
165.46
mp-777610
14.859601
8.059134
-5.047295
other
Li4Cr7P6O24
41
8
517.42
mp-2231764
6.605902
13.378341
-2.103987
other
Mg1Co5Sn1O12
19
8
218.7
mp-1235169
7.70531
10.258685
0.708712
other
Ba4Li1Rh4O12
21
8
297.62
mp-2225606
12.694091
11.96141
-1.357272
other
Mg1V1Mo1O5
8
8
95.43
mp-773058
9.987564
10.485476
1.330096
other
Ba6Ti7Sb9O42
64
8
877.82
mp-2231399
9.118852
8.749005
1.206146
other
Ba5Mg1Bi3O11
20
8
409.91
mp-753045
13.441811
12.662365
-0.55557
other
Li8V4O8F4
24
8
223.36
mp-757180
7.20066
13.577916
-2.013844
other
Ti3Mn2Co3O16
24
8
246.33
mp-1650411
5.972569
11.010158
0.137652
other
Sr10Fe8Mo2O30
50
8
619.83
mp-2225366
11.139577
10.281349
1.414947
other
Sr1Mg1Cr1O3
6
8
94.84
mp-1212530
7.113723
2.567794
-2.320731
other
Ge1C2N6F6
15
8
222.3
mp-1218400
8.041535
9.694436
1.39735
other
Sr1Ca3Cu2O6
12
8
159.62
mp-1174817
3.718861
23.568165
-1.315767
other
Li8Mn2Co4O14
28
8
253.08
mp-1175165
3.74605
23.629135
-1.276004
other
Li7Mn2Co3O12
24
8
217.15
mp-775511
11.360967
11.285381
-2.407805
other
K1Li1W6O18
26
8
383.01
mp-1224160
10.56941
12.244119
2.370999
other
K2Sr1Ti10O22
35
8
453.6
mp-2240957
11.562738
10.850174
0.505608
other
Na1Mg1Fe1O2
5
8
70.56
mp-1218660
-5.485153
-5.791062
0.836927
other
Sr12Yb8Cd10Sb20
50
8
1,604.65
mp-1219148
11.70195
9.681742
2.794363
other
Sm4Ti4S4O9
21
8
310.85
mp-759609
10.554184
13.20961
-0.563929
other
Li5V1O4F1
11
8
105.22
mp-1100642
3.918679
23.001446
-1.338462
other
Li9Mn2Co5O16
32
8
289.11
mp-772071
7.469903
14.248239
-1.122092
other
Li4Mn3Fe5O16
28
8
282.89
mp-2218240
11.880001
10.762504
0.996893
other
Dy2Mg1V2O7
12
8
178.35
mp-1239057
8.02124
9.552903
-3.40311
other
Mn3Zn2As1O12
18
8
277.39
mp-753535
11.658197
12.233465
0.111701
other
Li20V4O12F8
44
8
438.44
mp-881153
13.444182
12.656284
-0.476306
other
Li8V4O8F4
24
8
231.28
mp-1175296
6.359283
20.34479
-0.440101
other
Li7Mn4Co1O12
24
8
218.11
mp-1177355
14.368294
7.634949
-6.981672
other
Li4Mn7P6O24
41
8
519.06
mp-2230090
5.893198
11.629972
-1.40021
other
Na4Mg1Fe4O10
19
8
222.25
mp-756838
9.149243
13.675994
-1.569337
other
Mn3Cr3Sb2O16
24
8
278.41
mp-1221781
-6.132536
-3.155117
-2.161079
other
Mn1In1Cu1Te3
6
8
187.33
mp-2231106
6.834909
13.215165
-1.99628
other
Mg1Co5Sb1O12
19
8
236.69
mp-1100676
3.917737
22.972342
-1.339946
other
Li9Mn2Co5O16
32
8
287.7
mp-2226932
1.475917
2.01077
-4.064732
other
Mg1W1Br4O1
7
8
200.34
mp-2227538
10.382843
10.620945
0.33394
other
Na1Mg1Ni1O2
5
8
65.99
mp-1174194
4.451654
22.508396
-1.063076
other
Li6Mn2Co2O10
20
8
181.96
mp-1234045
9.714005
12.063129
-0.703948
other
Ca1Co5Sb1O8
15
8
174.98
mp-1101353
11.644895
12.289501
2.460819
other
Sr2Ti6N2O11
21
8
269.67
mp-1100627
3.660249
23.392826
-1.401429
other
Li9Mn2Co5O16
32
8
287.91
mp-2218607
-5.845673
1.894143
-4.890059
other
Mg1Mo2W2S8
13
8
321.24
mp-1210386
-3.388424
-1.328771
-5.241511
other
Na2Sb8S13O2
25
8
672.87
mp-1084840
10.316863
9.651617
0.421943
other
Ti1Zn1Bi2O6
10
8
146.03
mp-2240242
6.400503
13.512269
-1.937477
other
Mg1Fe1Co2O6
10
8
102.26