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-1221213
8.357203
13.535568
-0.845522
other
Na3Ti1Fe3O8
15
10
174.71
mp-765027
5.785969
12.342982
-1.878542
other
Li4Fe9Co1O20
34
10
367.46
mp-1100715
4.071487
22.604944
-1.3601
other
Li9Mn2Co5O16
32
10
284.44
mp-1247190
-4.850561
-0.354919
-5.455977
other
Zr2Cr2Ag2S8
14
10
286.53
mp-759119
13.369396
12.581992
-0.498039
other
Li4V2O4F2
12
10
109.94
mp-2230037
10.706566
14.164187
-1.112862
other
Mg1Mn6O8F4
19
10
229.01
mp-759813
12.872697
12.317137
0.245017
other
Li8Ti4V4O16
32
10
302.31
mp-1239275
-4.997782
-0.514088
-5.364751
other
Zr2Cr2Cu2S8
14
10
253.85
mp-1247670
6.947768
12.105349
1.509587
other
Sr3Ca5Mn8O22
38
10
460.17
mp-754778
8.708257
14.034773
-0.779144
other
Li2Cr1Cu1O4
8
10
72.8
mp-2217378
13.611858
8.065797
-0.783059
other
Mg1Cu2Si2O6
11
10
144
mp-1174914
3.911161
23.31189
-1.243012
other
Li7Mn2Co3O12
24
10
215.89
mp-2230073
10.632949
14.16925
-0.940071
other
Mg1Mn6O8F4
19
10
226.15
mp-2230621
11.955288
10.52957
2.416795
other
Ba2Mg1Nb4O12
19
10
290.99
mp-1100718
6.541378
16.955729
-1.199914
other
Li9Mn2Co5O16
32
10
255.49
mp-759947
13.771824
13.098143
-0.804582
other
Li12V8O16F8
44
10
459.42
mp-759773
6.212931
13.595059
-2.037464
other
Li4Fe3Co7O20
34
10
366.94
mp-1228450
5.999022
8.586654
-0.808357
other
Ba4Bi1Pb3O12
20
10
333.84
mp-1221712
8.12926
13.409483
-1.177242
other
Mn1Cu1Ag2O4
8
10
101.26
mp-769507
6.34203
13.653977
-1.350981
other
Li10Co1Ni9O20
40
10
339.73
mp-1174343
5.004932
21.317186
-0.927779
other
Li5Mn2Co1O8
16
10
143.89
mp-1174170
7.279915
18.632664
-0.38521
other
Li4Mn3Co1O8
16
10
151.82
mp-1100729
3.894566
22.934122
-1.347154
other
Li9Mn2Co5O16
32
10
285.93
mp-1273164
10.089121
0.554366
-0.051285
other
Li16Co4O4F20
44
10
449.29
mp-1239231
-5.437513
-0.138179
-5.525427
other
Ta1Cr3Cu2S8
14
10
239.15
mp-754402
11.006404
14.073943
-0.593076
original
Li4Mn2V2O8
16
10
152.8
mp-1313101
5.153579
21.151577
-0.931345
other
Li10Mn4Co2O16
32
10
279.44
mp-1174165
7.30843
18.567635
-0.362514
other
Li4Mn3Co1O8
16
10
151.94
mp-1239163
-5.424298
-0.119828
-5.538064
other
Ta1Cr3Cu2S8
14
10
243.42
mp-1174232
6.215775
18.200924
-1.121716
other
Li4Mn1Co3O8
16
10
145.71
mp-1209850
11.77115
7.559579
-2.777849
other
Ni5B2Sb1O10
18
10
184.97
mp-1174346
5.169939
21.176998
-0.941498
other
Li10Mn4Co2O16
32
10
276.04
mp-1216476
9.949235
12.341713
-4.005461
other
V8Cd3Cu1O24
36
10
441.5
mp-754945
7.995841
14.891346
-0.674916
other
Li2Mn1Ni1O4
8
10
71.28
mp-1175292
6.335121
20.358503
-0.446234
other
Li7Mn4Co1O12
24
10
218.18
mp-1100716
3.818686
23.187536
-1.342186
other
Li9Mn2Co5O16
32
10
290.18
mp-1101152
9.673512
14.465715
-0.324696
other
Li4Mn2Cr2O8
16
10
150.3
mp-1239262
-4.823288
-0.330986
-5.489706
other
Hf1Cr1Ag1S4
7
10
144.09
mp-1100735
3.786989
23.186892
-1.393873
other
Li9Mn2Co5O16
32
10
287.85
mp-643708
10.015581
3.059379
-3.940847
other
Li2H4I2O2
10
10
158.14
mp-2227155
11.613135
10.839087
0.122708
other
Mg1Mn1Sb1O4
7
10
93.05
mp-2229460
8.260503
9.408514
1.42475
other
Ba4Mg1Cu4O8
17
10
264.74
mp-1221613
-6.495734
-2.49311
-1.499067
other
Mn1V1Cr2Te4
8
10
179.91
mp-2230492
11.930414
11.76417
1.813252
other
Mg1Nb4Co2O12
19
10
223.81
mp-1174028
3.304613
22.276449
-1.643581
other
Li5Mn1Co2O8
16
10
141.25
mp-1174218
7.245812
18.70785
-0.387855
other
Li4Mn3Co1O8
16
10
151.75
mp-1100701
3.758438
23.236626
-1.393566
other
Li9Mn2Co5O16
32
10
287.07
mp-1177858
9.400209
13.710857
0.003846
other
Li4Ti2Co2O8
16
10
149.55
mp-2222885
11.686998
10.694974
0.162436
other
Mg1Cr1Sb1O4
7
10
95.92
mp-760397
6.788867
13.602189
-1.761588
other
Li1Co1Cu1O4
7
10
68.16
mp-1215769
8.933873
12.841085
-0.60217
other
Yb1Eu1Fe4O8
14
10
182.85
mp-1246998
-4.819199
-0.356118
-5.495525
other
Hf2Cr2Ag2S8
14
10
284.77
mp-755028
11.299196
13.43327
-0.021196
other
Li6Cr6Si2O16
30
10
286.04
mp-755501
9.633442
13.115708
-0.326747
other
Li4Co2Sn2O8
16
10
164.63
mp-2229825
7.988183
9.09414
1.288275
other
Ba4Mg1Cu4O8
17
10
302.17
mp-1220518
-3.314428
0.282965
-0.171714
other
Nb4Ni1C2S4
11
10
161.07
mp-1174001
3.498238
22.261507
-1.502205
other
Li5Mn1Co2O8
16
10
141.32
mp-769553
6.585352
14.263194
-1.43747
other
Li10Co4Ni6O20
40
10
337.07
mp-1100695
3.869339
23.098581
-1.332124
other
Li9Mn2Co5O16
32
10
291.16
mp-1100728
3.656691
23.345787
-1.420247
other
Li9Mn2Co5O16
32
10
287.03
mp-1219413
-8.798374
-1.788236
3.97377
other
Sc8B8As3Rh20
39
10
536.25
mp-753409
7.031793
14.206677
-1.173074
other
Li2Fe1Co1O4
8
10
73.71
mp-754247
10.880033
13.54473
-0.04997
other
Li8Cr6Ga2O16
32
10
295.22
mp-754241
10.305774
13.770687
-0.316134
other
Li4Cr3Fe1O8
16
10
148.01
mp-1100737
4.212319
22.414913
-1.305551
other
Li9Mn2Co5O16
32
10
282.64
mp-1301284
8.809477
13.595779
-0.808475
other
Li6Co8Sn2O16
32
10
314.86
mp-1220451
-3.168745
0.351171
-0.002503
other
Nb4Cr1C2S4
11
10
165.21
mp-1100724
3.732606
23.175859
-1.425207
other
Li9Mn2Co5O16
32
10
288.61
mp-1182875
8.625759
1.9992
-0.839677
other
Al2Hg4O4F10
20
108
266.25
mp-1191148
13.25713
4.99152
-2.889907
other
Sr2Cu4B4O12
22
108
283.15
mp-1195654
-3.365717
-1.746615
-5.285401
other
Ba18U8Ag20S48
94
108
2,402.6
mp-556500
8.150178
2.808137
-1.399142
other
N2Cl2O2F8
14
108
209
mp-556898
13.601184
7.950285
-6.648712
other
V2Zn4P4O18
28
108
377.07
mp-1189716
8.539532
2.262609
-1.021668
other
Al2Hg4O4F10
20
108
296.04
mp-1216465
11.498071
6.06841
-4.86735
other
V2As4H8O18
32
108
366.57
mp-769316
8.804921
1.683902
0.686079
other
Li10Nb6O2F36
54
108
689.94
mp-540995
8.509759
1.434303
0.931549
other
Rb10Nb6O2F36
54
108
998.13
mp-1218151
6.966897
10.974142
1.390105
other
Sr1Nd1Co1O4
7
107
91.52
mp-1218398
9.46736
8.181369
-0.68399
other
Sr1Bi3Cl3O4
11
107
218.82
mp-1212030
5.830597
5.202615
-4.229107
other
Ir1N7Cl1O6
15
107
259.31
mp-1218496
7.996516
10.84326
2.072395
other
Sr3Nb1Co1O7
12
107
165.79
mp-1225155
-6.480735
-3.029639
4.617102
other
Eu1Si1Ni2Ge1
5
107
82.68
mp-1217973
11.550475
10.520045
1.37862
other
Sr1Pr1V1O4
7
107
97.08
mp-1225609
11.201165
8.041318
2.682268
other
Er2U1S3O2
8
107
150.32
mp-1218461
7.017392
11.103367
0.95699
other
Sr3Fe1Ru1O7
12
107
160.91
mp-1025277
10.553587
8.670258
3.140946
other
Pr2Al1N1O3
7
107
89.36
mp-1228075
7.037442
8.918276
-1.815299
other
Ba1Bi2Br2O5
10
107
218.21
mp-1228116
9.231568
8.515893
-0.20937
other
Ba1Bi2I2O2
7
107
294.98
mp-2227604
11.159893
9.152938
2.033195
other
Nd2Mg1Cu1O4
8
107
119.07
mp-1218155
6.978534
11.008612
1.35346
other
Sr1La1Ni1O4
7
107
93.12
mp-1218478
5.855344
11.140678
0.291639
other
Sr6Mn2Fe2O14
24
107
308.25
mp-1218289
8.18601
10.971531
1.39912
other
Sr1Dy2Fe2O7
12
107
145.56
mp-1227965
9.179189
8.319796
-0.175935
other
Ba1Bi1Cl1O2
5
107
115.86
mp-1218137
9.821065
10.648601
2.207982
other
Sr1Nd1Cr1O4
7
107
94.37
mp-1227092
10.470586
8.482426
2.577224
other
Ca1Gd1Al1O4
7
107
81.69
mp-2232863
11.591492
11.036184
0.942728
other
Sr4Mg1V3O10
18
107
270.67
mp-1226975
1.420683
2.142845
1.806936
other
Ce2Mn1N3F1
7
107
95.22
mp-1217760
7.01858
11.041503
1.271635
other
Sr1Sm1Ni1O4
7
107
89.4
mp-1218276
7.62416
8.709578
-0.157634
other
Sr1Eu1Al1O4
7
107
87.77
mp-1218139
11.460626
10.470204
1.414664
other
Sr2La2V2O8
14
107
196.38