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-1446296
12.676444
10.966028
0.499351
other
Mg4V4O8
16
12
211.24
mp-30272
-7.312188
-2.671182
6.041765
other
U4Al38Co12
54
12
832.18
mp-1005753
-6.819148
-4.537948
5.165051
other
Sm4Al2Ge12
18
12
377.92
mp-769702
8.360184
14.702393
-1.356288
other
Li1Mn4O8
13
12
149.66
mp-777317
7.635917
13.71526
-1.633981
other
Mn14Fe6O40
60
12
719.42
mp-2222812
-3.34432
-0.72605
-4.626667
other
Mg1V1S2
4
12
138.12
mp-1174036
6.823653
19.861856
-0.266304
other
Li6Mn4O10
20
12
181.56
mp-1307826
6.333987
13.857044
-2.166619
other
Li2Co6O12
20
12
209.07
mp-1079688
-5.256063
-3.202251
4.682808
other
Hf4Cu1Si4
9
12
146.43
mp-779899
9.367713
2.591028
-1.106035
other
Fe6O7F6
19
12
272.92
mp-1042216
9.554644
8.574071
-0.134379
other
Ca2Bi4O8
14
12
248.93
mp-1238772
-3.026359
-2.329268
-5.879675
other
Tm2Mg2S6
10
12
250.65
mp-761148
10.500498
12.391709
1.810909
other
Ti9Sn1O20
30
12
327.29
mp-1190468
11.949766
11.737133
2.071745
other
Na4Ti6O13
23
12
265.85
mp-1029784
4.65292
2.166751
-2.710724
other
Rb6C3N6
15
12
310.26
mp-997101
6.750549
6.034039
-3.745342
other
Ag2O4F2
8
12
122.58
mp-1217516
-7.413561
-3.984353
3.727722
other
U2Ni2Sn2
6
12
115.97
mp-1209068
10.389647
11.307801
-2.013433
other
Re2Ni2O8
12
12
130.59
mp-1105830
2.770247
-0.344822
-1.684944
other
Zr4Cu2H10
16
12
137.56
mp-760400
6.43646
8.89587
-0.718154
other
Na5Bi1O5
11
12
150.56
mp-761020
10.71739
0.687564
-0.997264
other
Co8O4F12
24
12
271.06
mp-1225608
-2.622147
-2.829767
-5.444634
other
Er3Sc2S7
12
12
249.77
mp-1025326
-3.309002
0.538101
2.73638
other
Tb2Mo2C3
7
12
104.43
mp-1247014
1.423667
1.829601
1.38634
other
Ca9Mn2N8
19
12
334.09
mp-1215551
-7.681645
-6.046752
4.338295
other
Yb2Zn2Ga2
6
12
124.58
mp-1189018
8.672241
1.192584
1.33177
other
Na5Hf2F13
20
12
257.24
mp-1042530
12.773198
10.55712
0.244651
other
Ca2Mo4O8
14
12
190.36
mp-1237181
13.525271
7.735757
-1.214581
other
Fe1B6O6
13
12
101.97
mp-1042581
12.948431
10.646979
-0.026902
other
Mg2Mo4O8
14
12
188.39
mp-755186
9.942108
2.462596
1.5764
other
Li4V4F16
24
12
331.07
mp-13264
-3.425648
0.456134
2.739424
other
Sm2Mo2C3
7
12
109.45
mp-12004
-5.020482
-4.177011
6.419107
other
Er2Al3Si2
7
12
129.27
mp-1025268
-3.056128
0.280863
2.541385
other
Pu2W2C3
7
12
102.93
mp-758848
11.139105
12.260103
2.05704
other
Ti5Nb1O12
18
12
198.42
mp-1042234
10.557878
9.299701
0.489507
other
Ca2Sn4O8
14
12
218.27
mp-1232282
-4.510419
-3.955763
-3.87468
other
Nd2Mg2Se6
10
12
299.53
mp-1220242
6.287349
5.69736
-4.422815
other
Nd2N2O12
16
12
223.33
mp-758249
5.623566
11.934871
-1.97812
other
Li1Fe3O6
10
12
116.69
mp-755872
8.344784
12.64349
-1.847522
other
Co8Te2O16
26
12
315.72
mp-667192
-0.611624
0.737287
-2.590514
other
La8C10Cl4
22
12
454.46
mp-1205642
-5.188463
-3.99027
6.095135
other
Tb4Co2Si4
10
12
189.78
mp-2216492
8.646611
14.835915
-0.851621
other
Mg1Mn3O6
10
12
124.44
mp-1207111
-3.250565
-5.030357
6.537922
other
Mg2Al3Si6
11
12
182
mp-29683
7.619303
11.09461
0.002751
other
Sr2Ru3O10
15
12
207.34
mp-1178196
12.499687
7.568603
0.652524
other
La1Al33O51
85
12
942.32
mp-548479
11.339598
8.862961
1.036736
other
Cs2U2O7
11
12
218.31
mp-755276
7.916008
13.943316
-1.652596
other
Mn5Fe1O12
18
12
220.68
mp-1208421
11.008385
10.097669
1.915418
other
Tb5Re2O12
19
12
252.4
mp-765020
5.754627
10.938807
0.073139
other
Sr24Fe16O53
93
12
1,262.43
mp-1216137
-8.636574
0.052666
4.358198
other
Y2Co17C1
20
12
247.16
mp-7443
-4.790726
-1.245191
-2.724916
other
Nb2Cr1Se4
7
12
139.57
mp-34289
-4.068381
0.004328
-4.092975
other
Ti1Nb1S4
6
12
121.64
mp-530294
10.39799
9.352313
3.750876
other
Sm16Zr16O56
88
12
1,231.74
mp-690575
9.229353
6.715693
-1.755147
other
Nb4Ni2O12
18
12
204.86
mp-654008
-5.488928
-0.132946
-5.670088
other
K3Cr11S18
32
12
609.99
mp-504567
8.271844
14.294539
-1.502308
other
Mn3Cu2O8
13
12
137.96
mp-644424
8.196741
10.178841
1.524085
other
Sr2Co1O3
6
12
135.45
mp-1199654
11.559363
7.180296
-6.183406
other
Ag6P6O20
32
12
467.39
mp-1175359
6.905701
19.783171
-0.196382
other
Li14Mn10O24
48
12
442.81
mp-1175480
4.556965
19.070316
-1.800815
other
Li9Co7O16
32
12
278.77
mp-1176626
10.50004
0.125927
0.330493
other
Li2Mn2F8
12
12
168.17
mp-1190610
-7.893466
-6.479025
6.243027
other
Ho14Te4Au4
22
12
604.66
mp-685137
11.468731
8.201827
2.945114
other
Ce2Sb1O2
5
12
100.9
mp-781606
8.007113
5.24177
-1.338579
other
Fe8O10F6
24
12
273.04
mp-1025231
-2.700321
-2.642227
-5.826701
other
Pr2Cr1S4
7
12
172.33
mp-1217725
-7.683683
1.047685
4.868721
other
Tb2Fe17C2
21
12
267.46
mp-1225754
-8.195215
-4.656391
5.5267
other
Dy2Ga2Ni2
6
12
108.52
mp-1220542
-7.705118
1.099536
4.919015
other
Nd2Fe17N2
21
12
272.98
mp-1395869
12.897479
12.450247
-0.628758
other
Mg2V4O8
14
12
162.93
mp-15885
-2.981818
-2.330632
-4.859265
other
Li4U2S6
12
12
239.14
mp-1079004
10.206913
11.616893
2.716011
other
Ce1Ti2O6
9
12
112.07
mp-1246495
0.35464
2.504084
1.98059
other
Ca1Mn10N8
19
12
207.31
mp-1175415
4.72306
18.81456
-1.776806
other
Li9Co7O16
32
12
274.76
mp-1406912
8.994098
13.602964
-1.281171
other
Mg2Cr3O8
13
12
139.37
mp-755620
6.367463
13.547696
-2.362144
other
Mn1Co5O12
18
12
199.22
mp-774467
12.740416
12.615036
-0.685723
other
Li2V2O4
8
12
75.62
mp-755214
10.382168
12.639634
-3.775988
other
Na2V6O15
23
12
295.46
mp-760334
13.151065
13.335938
-1.89257
other
V6O10F2
18
12
192.9
mp-1380716
7.463515
11.675737
-1.814284
other
Al10Ni6O24
40
12
391.13
mp-1218290
-4.185924
-3.293476
-4.206663
other
Sr1Eu4Se5
10
12
293.41
mp-1210548
8.26125
2.764092
-1.096919
other
Nb1N3F12
16
12
296.99
mp-756119
10.162047
0.891576
1.537237
other
Li4Mn2F8
14
12
187.77
mp-13744
9.799018
8.393305
-0.114602
other
Rb6Ga2O6
14
12
281.01
mp-1283250
5.801074
11.66041
0.090386
other
Ba4Co4O12
20
12
275.39
mp-758038
9.870858
10.918516
3.358543
other
La4Ti6O18
28
12
357.95
mp-1104962
-4.967617
-5.190216
0.464249
other
Eu4Cd4As6
14
12
362.62
mp-1246172
0.292504
2.552746
1.956505
other
Mn3Co8N8
19
12
172.87
mp-1224641
-5.416295
-4.29936
5.451373
other
Gd2Si2Pd2
6
12
115.71
mp-1025224
-5.523777
-0.061006
-5.260464
other
V1Cr2S4
7
12
116.04
mp-1104038
4.7636
3.114466
-3.459695
other
K2Cd1N12
15
12
305.42
mp-762391
5.898193
13.088713
-1.465802
other
Li2Ni3O6
11
12
103.46
mp-1175447
4.455867
19.175993
-1.816632
other
Li9Co7O16
32
12
281.01
mp-1189861
8.772001
14.745884
-0.944496
other
Mn7Bi1O12
20
12
217.79
mp-1226238
9.361302
12.357758
-1.36493
other
Co14Sb4O24
42
12
493.72
mp-31256
10.932247
9.754395
0.441107
other
U1Sb2O6
9
12
134.93
mp-1205522
-5.169473
-3.690478
6.118239
other
Y4Fe2Si4
10
12
194.38
mp-18870
8.36592
14.202674
-1.279495
other
Mn3Cd2O8
13
12
146.56
mp-1275718
7.326982
12.608403
-2.328029
other
Co6Te2O16
24
12
310.55
mp-1219954
-6.38937
-3.445432
0.738039
other
Ni2Sb12Ru2
16
12
392.86
mp-1396989
12.861159
12.655401
-0.846233
other
V4Zn2O8
14
12
145.73