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-1233128
9.371461
12.687244
-0.812865
other
Mg1Fe7Ni6O16
30
8
324.34
mp-757443
8.511317
12.273298
-2.050201
other
Co3Ni2Te3O16
24
8
279.07
mp-754681
9.193296
13.342303
-1.403033
other
Mn3Cr2Sb3O16
24
8
288.52
mp-1224722
12.678123
6.592254
-6.395314
other
K14P16Pd9O56
95
8
1,469.87
mp-1234591
11.528409
12.244889
-2.859975
other
K4Ca1V6O16
27
8
501.43
mp-1100641
3.27344
23.510794
-1.575569
other
Li9Mn2Co5O16
32
8
287.55
mp-1233470
11.724886
8.662015
1.985648
other
Mg1Zr3U7O20
31
8
403.07
mp-752433
11.342074
10.27919
2.795035
other
Li1La3Ti4O12
20
8
242.92
mp-1228766
11.061198
11.956462
-3.364399
other
Ba6Nd2V6O24
38
8
612.38
mp-2219422
13.553723
0.66112
1.30069
other
Mg1Fe4O5F3
13
8
159.4
mp-2217232
11.727939
11.628472
-2.183646
other
Mg1V1Ag3O4
9
8
159.37
mp-2230440
13.202738
0.87401
1.788198
other
Mg1Fe6O6F6
19
8
228.49
mp-1214020
13.46977
4.734807
-1.414873
other
Ca4Y1B3O10
18
8
229.3
mp-1275879
12.880287
12.516985
-0.028132
other
Li6Ti2V4O12
24
8
227.49
mp-1215328
10.669631
10.893597
2.448182
other
Zr1Ti2Pb3O9
15
8
205.43
mp-1276200
10.559704
0.347309
0.562617
other
Li6Mn2O2F8
18
8
190.56
mp-2236758
8.598009
11.564026
1.863893
other
Y6Mg1Mn6O18
31
8
410.41
mp-771243
9.047704
11.55697
-1.933168
other
Ti3Ni3Te2O16
24
8
283.38
mp-756331
7.23678
13.979487
-1.541015
other
Li4Ti3Co5O16
28
8
266.78
mp-2227579
10.313036
10.62983
0.318992
other
Na1Mg1Ni1O2
5
8
62.76
mp-1308806
10.018353
12.548633
0.221862
other
Li10Mn2O6F2
20
8
210.38
mp-1175312
5.797071
21.135811
-0.505244
other
Li7Mn4Co1O12
24
8
224.92
mp-1100678
3.972076
22.921835
-1.315534
other
Li9Mn2Co5O16
32
8
287.77
mp-759545
4.961695
19.004139
-1.597781
other
Li7Mn3Co3O16
29
8
276.11
mp-776608
11.500276
12.294649
2.457979
other
Ca2Ti6N2O11
21
8
264.54
mp-1175188
4.034944
23.222002
-1.194276
other
Li7Mn2Co3O12
24
8
220.03
mp-1223557
-4.361646
-3.330647
-3.12266
other
K1U2Sb1Se8
12
8
357.12
mp-2218565
9.567661
8.847651
0.36174
other
Na4Mg1Bi2O6
13
8
206.88
mp-770888
12.814248
11.529238
0.939992
other
Li4Nb5V3O16
28
8
321.72
mp-1100660
4.005702
22.792246
-1.33559
other
Li9Mn2Co5O16
32
8
287.42
mp-2224222
-1.204715
1.898644
-2.747938
other
Mg1Nb2I6O2
11
8
355.83
mp-1222644
6.541664
6.10278
-3.819025
other
Mg1Br1Cl1O6
9
8
145.22
mp-1174882
3.638787
23.453928
-1.400594
other
Li8Mn2Co4O14
28
8
252.67
mp-1235884
11.5395
10.039743
1.624079
other
Li1Y5Mo2O12
20
8
267.2
mp-560918
11.309916
8.983793
-6.544492
other
Ba4V10P8O48
70
8
1,048.44
mp-2218245
11.893364
10.83582
0.918097
other
Y2Mg1V2O7
12
8
178.69
mp-1177758
13.427272
12.720267
-0.479678
other
Li10V5O10F5
30
8
285.24
mp-2217074
-4.436887
-1.252731
-5.322559
other
Rb2Mg1Fe2S4
9
8
246.1
mp-1100662
3.948103
22.921558
-1.337694
other
Li9Mn2Co5O16
32
8
288.62
mp-2240038
-4.052942
-0.076035
-4.208789
other
Mg1Ti1Nb1S4
7
8
130.85
mp-1174986
3.729664
23.505623
-1.309381
other
Li7Mn2Co3O12
24
8
215.59
mp-861177
10.870363
0.131085
0.477305
other
Li4Mn2O2F6
14
8
145.06
mp-558708
11.712404
7.452786
-0.167201
other
Nd4Cu2Ge4O16
26
8
343.35
mp-754081
12.747853
12.712602
-0.363155
other
Li6Ti2V6O16
30
8
319.32
mp-2227228
13.634454
8.147193
-2.207689
other
Mg1Ni1H1O2
5
8
50.56
mp-1177893
11.924905
13.327023
-1.431292
other
Li2Mn1V3O8
14
8
154.61
mp-1235635
10.744452
12.187873
0.540923
other
Li1Dy2Mn4O8
15
8
198.41
mp-729255
7.704036
9.348442
-3.828178
other
Li3Cr4P1O19
27
8
449.31
mp-1288258
12.800283
12.305879
0.145995
other
Li8Ti4V4O16
32
8
295.57
mp-2219453
11.873772
13.164399
-2.207333
other
Mg1V3Co1O8
13
8
152.79
mp-727247
2.851151
3.165835
-4.128836
other
Na2Zn1Cl4O3
10
8
246.86
mp-2227993
-3.584487
-1.476453
-5.404434
other
Na3Mg1Sb1S4
9
8
244.39
mp-775922
11.316734
11.532969
3.200848
other
Sr2Nb6N2O14
24
8
360.01
mp-849248
14.37453
7.725251
-6.915817
other
Li4Mn7P6O24
41
8
505.53
mp-2226498
8.897028
12.625228
-0.739007
other
Mg1Co1Cu1O2
5
8
67.4
mp-1223345
10.580685
11.624414
3.273654
other
K1Na1Nb2O6
10
8
133.48
mp-756815
5.749192
12.532063
-1.694502
other
Li4Fe5Ni3O16
28
8
280.21
mp-761936
11.667016
7.485895
-6.985997
other
Li4Cu7P6O24
41
8
467.43
mp-1174066
4.352925
22.585743
-1.108416
other
Li6Mn2Co2O10
20
8
180.48
mp-1175014
3.234073
23.6446
-1.481356
other
Li7Mn2Co3O12
24
8
217.28
mp-1175151
3.746581
23.634216
-1.270177
other
Li7Mn2Co3O12
24
8
217.63
mp-1208996
7.124083
2.620417
-2.312457
other
Si1C2N6F6
15
8
213.83
mp-1174832
3.75551
23.220217
-1.394629
other
Li8Mn2Co4O14
28
8
251.83
mp-2226682
7.473772
12.554967
-1.127864
other
Mg1Zn2Ni4O8
15
8
154.71
mp-2227372
8.880226
14.46061
-1.143889
other
Mg1Mn3Cr1O8
13
8
149.21
mp-550751
12.633446
6.363839
-0.502078
other
Ba1Be1Si1O4
7
8
99.41
mp-755438
11.977896
0.637381
0.846479
other
Li2Fe4O4F6
16
8
195.35
mp-2218474
8.221679
12.764475
-1.690983
other
Mg1Co3Te1O8
13
8
157.52
mp-778794
11.257448
12.909857
-1.190108
other
V3Cr2Sb3O16
24
8
293.67
mp-2230781
6.253827
13.434795
-2.273287
other
Mg1Fe1Co5O12
19
8
212.67
mp-774230
12.505489
12.961047
0.325194
other
Li4Ti5V3O16
28
8
296.26
mp-1222639
8.006147
10.132218
-3.243214
other
Mn3Zn2As1O12
18
8
285.24
mp-759837
10.282447
14.17769
-0.31591
other
Li2Mn4O5F3
14
8
158.38
mp-1222381
-4.814092
-1.603185
-5.153369
other
Mn4In4Se5S5
18
8
447.87
mp-1216408
9.280309
8.72485
-0.73698
other
Zr2Ti3Pb5O15
25
8
788.96
mp-1233683
7.821568
10.186829
0.787033
other
Ba4Ca1Rh4O12
21
8
309.49
mp-2219206
9.891567
11.086433
-0.882996
other
Mg1Sb2Rh2O8
13
8
162.38
mp-1235716
11.38118
12.583931
0.007757
other
Li1Cr4Hg2O8
15
8
179.44
mp-2217353
9.155107
8.738601
0.855293
other
Ba2Mg1Bi2O6
11
8
219.21
mp-753245
8.963302
15.141582
-0.665734
other
Li2Mn4O6F2
14
8
156.42
mp-1234547
11.720031
8.665438
2.005659
other
Mg1Zr3U7O20
31
8
414.72
mp-2227000
12.06716
13.147061
-1.694588
other
Mg1V3Fe1O8
13
8
157.55
mp-2219427
6.808179
13.773148
-1.889029
other
Mg1Mn1Co3O8
13
8
147.25
mp-752612
10.153046
2.595543
1.868429
other
Li6V4O2F14
26
8
307.44
mp-1100659
3.8045
23.209505
-1.353335
other
Li9Mn2Co5O16
32
8
290.17
mp-1228292
12.839358
5.622325
-5.729711
other
Ba8P8H8O32
56
8
784.82
mp-1215653
10.643452
10.479172
2.835499
other
Zr4Ti1Pb5O15
25
8
372.77
mp-2240197
13.943259
9.107547
-2.100264
other
Mg1V2H2O5
10
8
99.08
mp-777002
11.903772
13.500258
-0.798489
other
Li4V5Cr3O16
28
8
289.15
mp-1224603
10.731798
10.777688
2.757581
other
Hf3Ti2Pb5O15
25
8
347.55
mp-1176503
6.545147
13.522881
-2.12484
other
Mn3Fe2Co3O16
24
8
255.96
mp-2217189
7.328992
13.901124
-1.737139
other
Mg1Mn1Co2O6
10
8
122.65
mp-1197555
10.5083
7.010125
-2.016175
other
Ca2Al4Si8O28
42
8
707.06
mp-1306042
6.063097
11.455628
0.619599
other
Sr1La2Co3O9
15
8
175.66
mp-2229191
12.799961
11.789518
2.482918
other
Mg1Ti6N4O6
17
8
195.46
mp-2218792
10.461592
11.823441
-0.62078
other
Mg1Fe2Sb2O8
13
8
150.41
mp-1174870
3.828299
23.314756
-1.307475
other
Li8Mn2Co4O14
28
8
252.97
mp-1176678
7.922915
13.21755
-0.992355
other
Li4Fe4Sn4O16
28
95
322.75
mp-765593
14.885972
7.821946
-5.205935
other
Li4Fe4P4O16
28
95
269.94
mp-774424
10.649735
13.473547
-2.23057
other
Li4Mn4V4O16
28
95
309.59