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-1175271
6.359798
20.31959
-0.442842
other
Li14Mn8Co2O24
48
10
437.35
mp-2227370
12.76484
12.012592
0.568223
other
Mg1Ti1V1O4
7
10
78.1
mp-755399
9.147229
12.498848
-0.338963
other
Li2Cu1Sn1O4
8
10
82.66
mp-2230473
6.287583
9.558942
-1.582837
other
Mg1Co2Bi4O12
19
10
257.79
mp-1644003
11.147891
11.881192
0.199785
other
Sr6Ca2V8O24
40
10
476.45
mp-1174024
6.106758
18.338591
-1.142119
other
Li4Mn1Co3O8
16
10
145.07
mp-754100
6.866119
13.427923
-1.076297
other
Li2Fe1Cu1O4
8
10
73.68
mp-1174134
5.299042
20.989725
-0.868018
other
Li5Mn2Co1O8
16
10
140.15
mp-1180825
0.858942
2.089794
-4.028487
other
K4I4Br8O4
20
10
789.24
mp-1216916
10.389289
12.359701
-0.139773
other
Ti1Cu2Ni1O4
8
10
81.7
mp-1174881
3.977424
23.146164
-1.256395
other
Li7Mn2Co3O12
24
10
214.63
mp-2225894
8.029013
14.448231
-1.175324
other
Mg1Mn1Co1O4
7
10
72.24
mp-754321
12.549353
13.060663
-0.411266
other
Li4V3Cr1O8
16
10
152.02
mp-1652433
5.301836
10.885886
-1.113999
other
Sr8Ca2Fe10O30
50
10
594.4
mp-1212081
10.528065
9.268854
-0.11642
other
In4Ga4Sn4O20
32
10
427.77
mp-1175293
6.594238
19.9935
-0.418049
other
Li7Mn4Co1O12
24
10
217.7
mp-1238861
-5.149228
-0.108423
-5.423136
other
Ti2Cr2Cu2S8
14
10
234.65
mp-2226906
12.855508
11.133654
1.01673
other
Mg1Nb1V1O4
7
10
81.43
mp-1225818
-8.285189
-0.234374
4.796685
other
Dy1Ga1Fe1Co3
6
10
87.02
mp-1100690
3.453655
23.553366
-1.479168
other
Li9Mn2Co5O16
32
10
286.16
mp-1100689
3.548574
23.145132
-1.454277
other
Li9Mn2Co5O16
32
10
292.15
mp-1100714
3.965
22.823557
-1.336572
other
Li9Mn2Co5O16
32
10
288.12
mp-1247303
-4.94709
-0.43233
-5.404872
other
Hf2Cr2Cu2S8
14
10
257.93
mp-2240244
12.505263
11.349336
0.06316
other
Mg1V1Sn1O4
7
10
85.18
mp-1220754
1.786365
1.92326
2.561697
other
Na1Hf4N4Cl4
13
10
230.66
mp-1100731
3.772949
23.308542
-1.349315
other
Li9Mn2Co5O16
32
10
291.23
mp-1239222
-5.440881
-0.142226
-5.552125
other
Nb1Cr3Cu2S8
14
10
241.05
mp-2231867
5.88912
12.354644
-1.989112
other
Mg1Fe6O10F2
19
10
218.8
mp-754391
11.291037
12.859185
0.419823
other
Li8Ti4Fe4O16
32
10
306.28
mp-754054
12.148374
13.253019
-0.264169
other
Li4V2Cr2O8
16
10
149.02
mp-1174355
4.919914
21.525431
-0.942174
other
Li5Mn2Co1O8
16
10
141.71
mp-570060
-1.614413
0.859591
0.804455
other
Ce6B2C3Br3
14
10
293.58
mp-2227640
11.68993
11.478278
0.161665
other
Mg1Cr1Sb1O4
7
10
89.6
mp-2228351
8.748781
15.014565
-1.095082
other
Mg1Mn6O10F2
19
10
215.19
mp-757287
5.889081
13.033508
-1.565038
other
Li6Fe2Ni8O20
36
10
349.77
mp-1216344
12.291845
12.551191
-0.340606
other
V2Ga2Cu4O8
16
10
186.78
mp-1218378
1.072707
1.935918
-1.07
other
Sr4Br1N2Cl1
8
10
195.07
mp-1100694
3.694909
23.294659
-1.428337
other
Li9Mn2Co5O16
32
10
284.66
mp-2217428
8.067645
10.820104
-0.516429
other
Mg1Cu2Pd2O4
9
10
120.49
mp-2218351
12.832307
1.195854
1.984068
other
Mg1Fe4O4F4
13
10
153.51
mp-1204763
6.746269
6.630046
-3.84037
other
Ag4N8Cl4O16
32
10
528.34
mp-2231143
10.152081
1.426744
-1.387991
other
Mg1Co6O6F6
19
10
220.9
mp-1238850
-4.99768
0.013546
-5.503183
other
Ti2Cr2Ag2S8
14
10
266.09
mp-1178023
8.412325
13.935909
-0.707379
other
Li2Cr1Ni1O4
8
10
72.03
mp-754914
10.821515
13.493364
0.484976
other
Li8Ti4Mn4O16
32
10
314.83
mp-1174874
4.039245
23.012793
-1.245741
other
Li7Mn2Co3O12
24
10
212.75
mp-2227734
10.591913
11.843721
-0.136459
other
Mg1Mn1Sb1O4
7
10
90.36
mp-1239124
-4.998948
-0.486865
-5.358642
other
Zr2Cr2Cu2S8
14
10
258.79
mp-2231997
10.653817
14.287416
-1.042331
other
Mg1Mn6O8F4
19
10
227.18
mp-2225382
6.80732
13.30679
-1.367391
other
Mg1Fe1Co1O4
7
10
75.6
mp-754607
7.97245
15.671146
-0.554782
other
Li2Mn1Fe1O4
8
10
76.05
mp-769449
8.047693
14.32862
-1.173551
other
Li8Mn10Fe8O36
62
10
660.89
mp-1100696
3.863757
23.007919
-1.3408
other
Li9Mn2Co5O16
32
10
287.83
mp-2230342
11.791266
11.920288
1.714728
other
Mg1Nb4Ni2O12
19
10
218.85
mp-1175275
6.44731
20.198715
-0.458237
other
Li14Mn8Co2O24
48
10
427.88
mp-1174173
7.208842
18.75643
-0.353844
original
Li4Mn3Co1O8
16
10
152.02
mp-1216877
-4.961627
0.285151
-4.792168
other
Tl2V9Cr1S16
28
10
470.86
mp-1174187
7.24034
18.658474
-0.384869
other
Li4Mn3Co1O8
16
10
153.02
mp-2239972
12.924417
8.356411
-0.871569
other
Mg1Cu2Ge2O6
11
10
144.33
mp-2229988
7.707095
11.364807
1.095227
other
Sr4Mg1Fe4O11
20
10
262.37
mp-1218368
6.03307
8.706868
-0.622673
other
Sr2Ca2Pb2O8
14
10
213.34
mp-1100702
4.035612
22.701757
-1.344597
other
Li9Mn2Co5O16
32
10
282.73
mp-1174892
3.762722
23.436504
-1.309065
other
Li7Mn2Co3O12
24
10
214.53
mp-1304017
8.152871
14.701035
-1.215145
other
Li4Mn6Co2O16
28
10
287.23
mp-756673
10.924191
13.45442
0.053823
other
Li9Cr5Si2O16
32
10
279.07
mp-768676
9.411535
14.095737
-0.764089
other
Li12Cr12Ni4O32
60
10
578.73
mp-771690
5.929179
12.664232
-1.551379
other
Li3Mg1Ni3O8
15
10
137.8
mp-1224359
11.489696
11.024956
-3.642275
other
K5Sm1Mo4O16
26
10
466.01
mp-2230437
10.814209
14.187584
-1.086792
other
Mg1Mn6O8F4
19
10
228.75
mp-1173981
5.618976
19.189508
-1.24164
other
Li4Mn1Co3O8
16
10
146.35
mp-752817
5.948982
13.12049
-2.22964
other
Li2Fe3Co5O16
26
10
295.4
mp-850956
9.15997
14.260672
-1.113222
other
Li2Mn3Cr3O12
20
10
223.82
mp-1218579
7.458258
11.96193
1.981433
other
Sr4La1Mn5O13
23
10
304.87
mp-1100717
3.434632
23.676712
-1.445027
other
Li9Mn2Co5O16
32
10
289.47
mp-1100721
3.903442
22.951031
-1.377753
other
Li9Mn2Co5O16
32
10
287.46
mp-755008
6.719184
13.640368
-1.157133
other
Li2Fe1Ni1O4
8
10
69.86
mp-771052
6.659232
13.756808
-1.210333
other
Li10Fe3Ni7O20
40
10
353.35
mp-752940
8.630856
14.493129
-0.818137
other
Li2Cr1Co1O4
8
10
73.2
mp-1174334
5.097494
21.273829
-0.922961
other
Li10Mn4Co2O16
32
10
281.43
mp-1100697
4.103974
22.588146
-1.314542
other
Li9Mn2Co5O16
32
10
285.31
mp-1239197
-5.319943
-0.003116
-5.660642
other
Ta1Cr3Ag2S8
14
10
272.76
mp-754877
9.395177
14.421971
-0.727002
other
Li4Mn3Cr3O12
22
10
222.43
mp-1222956
-9.074444
-1.873229
3.2128
other
La1Al1Cu1Ni3
6
10
91.92
mp-1100722
3.695302
23.281103
-1.424418
other
Li9Mn2Co5O16
32
10
288.95
mp-1100727
3.789588
23.281034
-1.345446
other
Li9Mn2Co5O16
32
10
291.03
mp-755048
9.686899
13.941501
-0.47903
other
Li2Cr1Fe1O4
8
10
74.66
mp-1174900
3.407048
23.557825
-1.42746
other
Li7Mn2Co3O12
24
10
216.22
mp-1174027
6.006575
18.382883
-1.246013
other
Li4Mn1Co3O8
16
10
143.67
mp-1227721
10.716975
10.472662
0.934456
other
Ba2Sr8Fe10O20
40
10
592.79
mp-778996
6.220361
13.867898
-1.606791
other
Li8Co4Ni6O20
38
10
341.5
mp-753276
6.744248
14.290914
-1.450788
other
Li4Co2Ni2O8
16
10
143.27
mp-2230926
6.340975
9.579997
-1.586161
other
Mg1Ni2Bi4O12
19
10
256.34
mp-754209
9.914725
13.925001
-0.524205
other
Li4Cr3Ni1O8
16
10
144.11
mp-755308
6.723977
13.5422
-1.279067
other
Li2Cu1Ni1O4
8
10
69.87
mp-2230187
6.485317
13.196806
-2.362765
other
Mg1Co6O10F2
19
10
198.47
mp-754183
10.515937
13.740541
-0.900833
original
Li2V1Ni1O4
8
10
73.1
mp-2241896
10.322507
9.912892
-1.266351
other
Mg1Cu1Te1O4
7
10
98.87
mp-1223663
7.302342
8.451218
-0.275512
other
K2Ca1Pr1O4
8
10
142.34
mp-755815
8.73639
14.107349
-0.724671
other
Li4Cr1Fe3O8
16
10
149.99
mp-768763
10.941404
13.430758
-0.032227
other
Li8Al2Cr6O16
32
10
287.92