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-2981
10.209008
9.34033
-1.941596
other
Ca18Te18O54
90
2
1,546.91
mp-1175476
4.158371
19.646107
-1.792331
other
Li9Co7O16
32
2
286.92
mp-1003484
8.543566
14.794859
-0.997598
other
Mg1Mn4O8
13
2
152.64
mp-1344662
7.422554
5.071093
-1.846661
other
Al2Si6O16
24
2
364.78
mp-568146
-3.705955
-1.533538
-3.541667
other
Pd1Se6Br2
9
2
256.65
mp-1211789
8.618027
1.58253
0.499732
other
Li3Sb1F6
10
2
242.06
mp-26756
10.569381
8.101665
-7.016578
other
Fe8P14O48
70
2
914.99
mp-1369693
12.78878
6.667624
-6.877256
other
Sn2P4O14
20
2
270.69
mp-758169
10.729375
12.602612
-3.738725
other
K2V12O28
42
2
635.62
mp-1247452
1.938671
2.021986
1.303016
other
Sr6Sb6N10
22
2
475.75
mp-1220701
-4.299398
-0.907635
-3.166943
other
Nb3Ir2Se10
15
2
361.6
mp-757059
9.718381
8.025269
-6.443144
other
Mn2P4O14
20
2
270.28
mp-3312
-4.484536
-2.788934
-3.59901
other
Cs2Sb4Se8
14
2
459.17
mp-1019713
11.422095
7.215542
-0.4753
other
Cs16Si12O32
60
2
1,262.33
mp-766358
9.542149
8.51298
-0.555041
other
Bi10O14F2
26
2
507.46
mp-1310203
12.798485
7.715053
-6.449779
other
Co6P4O16
26
2
298.25
mp-1286297
12.059694
11.231724
0.305975
other
Mg6Fe4O10
20
2
189.12
mp-757943
7.68402
11.77227
2.19246
other
La10Mn9O30
49
2
607.89
mp-1216484
-7.418126
0.862801
5.006471
other
Y4Fe29Si5
38
2
506.89
mp-1214920
7.936942
7.944169
-3.890963
other
As4Pb2O16
22
2
345.02
mp-777349
12.902973
-0.905266
0.431732
other
Mn6O6F6
18
2
205.92
mp-28464
-5.311677
-2.204159
-2.303729
other
Re6Te14I14
34
2
1,280.27
mp-1217205
-4.029254
-0.089802
-4.525629
other
Ti5Cu1S10
16
2
294.88
mp-683937
-7.469501
-1.76881
2.057711
other
Ni52Sn32P12
96
2
1,486.55
mp-1181389
6.873902
6.224247
-3.90253
other
K4W4O30
38
2
767.66
mp-766611
6.023592
13.072041
-1.5438
other
Li17Ni11O28
56
2
470.18
mp-1203268
7.984741
8.148717
-4.183692
other
V4P4O28
36
2
557.81
mp-1101413
13.887145
7.307824
-4.763035
other
Sn8P4O18
30
2
524.41
mp-759304
8.420255
10.850877
-0.106362
other
Na12Mn4O12
28
2
410.89
mp-1173962
6.916903
19.64146
-0.253917
other
Li6Mn4O10
20
2
180.99
mp-1204772
11.316193
8.001824
-4.525202
other
Co10As10O35
55
2
680.14
mp-752987
11.459228
1.555334
2.624057
other
Fe8O2F14
24
2
301.24
mp-1045951
11.265244
9.134056
0.293174
other
Zn4Sn4O8
16
2
259.57
mp-754591
12.990321
0.728876
1.942858
other
Fe6O4F8
18
2
215.15
mp-752432
10.105462
9.448924
3.300876
other
Gd6Nb2O14
22
2
304.9
mp-772017
1.108256
1.704517
-5.227101
other
Ba6La4Cl24
34
2
1,094.95
mp-768078
13.747594
7.957473
-0.897568
other
Cr8Si8O26
42
2
489.7
mp-26704
7.933282
8.083186
-3.954413
other
Fe4P6O24
34
2
409.29
mp-1419188
7.142988
8.55926
-1.166525
other
K4Pb4O8
16
2
299.49
mp-772221
-1.25798
1.919562
-1.64153
other
Ba10La6I38
54
2
2,836.42
mp-1183022
12.474887
7.144167
-5.263165
other
Al8P8O32
48
2
992.84
mp-1978357
7.012794
19.644907
-0.187507
other
Li14Mn10O24
48
2
441.2
mp-4093
11.622117
7.478065
-6.678083
other
Cu3P2O8
13
2
140.95
mp-27589
11.540982
7.378562
-6.174877
other
Cu5P2O10
17
2
192.41
mp-755926
7.192999
13.377822
-0.933539
other
Li6Co2O6
14
2
141.08
mp-909339
7.114945
6.209726
-2.740173
other
Pt4Pb2O8
14
2
195.37
mp-771669
8.014162
15.719806
-0.804501
other
Li5Mn5O12
22
2
231.66
mp-1226114
-4.520719
-2.258387
-3.243731
other
Eu2Zr5Se10
17
2
460.79
mp-1202986
9.656523
7.520821
-5.962129
other
P8Pb4O30
42
2
669.77
mp-2699756
6.640387
10.750757
-1.378823
other
Na4Co2O6
12
2
184.48
mp-1386542
7.720343
5.13986
-1.94696
other
Te6As4O22
32
2
505.51
mp-1173217
5.619558
10.861661
-0.356574
other
Sr8Fe6O20
34
2
492.31
mp-30120
6.366601
8.814426
-0.69105
other
K6Bi2O8
16
2
304.93
mp-752875
15.09064
12.549802
-0.856358
other
V6O8F4
18
2
203.76
mp-1179634
2.78627
2.706574
-3.708495
other
S4I8N8
20
2
664.91
mp-4804
9.828995
10.88971
-0.572084
other
Li8Te2O10
20
2
180.36
mp-1212418
8.496319
1.914973
0.828089
other
In3As1F6
10
2
317.95
mp-760274
10.178167
12.53089
-3.955715
other
Na6V24O60
90
2
1,214.43
mp-1246063
0.220747
2.391279
2.071948
other
V2Co8N8
18
2
162.5
mp-1214619
5.664232
2.829422
-3.537367
other
C40Cl36O2
78
2
1,696.21
mp-1274757
9.452314
13.519633
-0.808022
other
Mn2Fe4O8
14
2
159.08
mp-1178715
9.984062
9.349656
-2.189031
other
Yb4Te10O26
40
2
660.69
mp-683180
6.954398
8.632037
-1.046566
other
K8Pb8O16
32
2
598.99
mp-779470
12.309838
12.75021
2.38349
other
Ti34N12O48
94
2
1,112.23
mp-1214431
8.36066
2.260801
-0.241864
other
Cd1Sn3F6
10
2
2,427.18
mp-1100506
7.085909
19.691216
-0.115706
other
Li9Mn7O16
32
2
296.58
mp-1183015
13.223044
6.808328
-0.413662
other
Al8Si4O20
32
2
630.44
mp-1193076
8.690695
9.388381
-3.961495
other
Fe2Mo4O20
26
2
472.35
mp-754432
6.225244
9.889464
-2.043122
other
Na4Fe2O8
14
2
240.81
mp-1025502
9.044106
1.380907
0.375041
other
Ti1Cu1F6
8
2
99.71
mp-1303262
8.049541
17.316389
-0.097777
other
Li8Mn8O16
32
2
299.14
mp-1178795
8.576356
1.131418
1.194624
other
Yb4Be4F16
24
2
312.89
mp-3530
8.317948
2.389579
-0.956755
other
Au1O2F6
9
2
165.23
mp-1246621
1.752584
1.825036
1.213961
other
Ba6In6N10
22
2
454.12
mp-766289
11.608826
8.52787
2.015131
other
Zr1U9O20
30
2
392.48
mp-625316
11.657395
4.188106
-3.852174
other
Al2H6O6
14
2
109.03
mp-768095
13.143034
12.575185
-0.7844
other
K2V26O40
68
2
817.18
mp-779491
13.241879
6.415334
-6.42213
other
Ba4P16O44
64
2
1,105.79
mp-780393
13.608737
4.622586
-1.462938
other
Ho12B12O36
60
2
620.03
mp-760790
9.33634
0.81636
-0.364048
other
Li6Cu6F24
36
2
492.19
mp-680472
-1.901227
2.115541
-4.620555
other
Na2Mo12Br26
40
2
1,161.49
mp-1174266
4.111243
19.409998
-1.841953
other
Li7Co5O12
24
2
214.14
mp-1640196
7.049996
19.620327
-0.185642
other
Li14Mn10O24
48
2
440.47
mp-2226671
8.627995
10.706991
-0.043143
other
Mg1Cu2O2
5
2
85.31
mp-1188271
-1.12509
1.281164
-1.692931
other
Er6Ir1I10
17
2
633.47
mp-1333484
10.81302
8.217876
0.741647
other
Y11Ta5O28
44
2
585.62
mp-1247457
0.754014
2.195334
2.045734
other
Ca6Cr6N10
22
2
290.69
mp-1006591
-4.8118
-3.032478
-3.938352
other
Mg4In8Se16
28
2
784.2
mp-1106207
10.922004
7.071742
-5.791189
other
Sr2P4O12
18
2
309.94
mp-1190799
8.300407
7.412348
-4.80676
other
Ca2P4O18
24
2
424.96
mp-1101267
10.732815
12.043029
-3.254906
other
V12Pb8O36
56
2
795.34
mp-557416
10.94667
10.312541
-1.803867
other
Sb8Mo4O24
36
2
538.96
mp-1246241
0.014203
2.440662
1.960167
other
Fe8Ru2N8
18
2
170.24
mp-1101006
10.344728
12.210653
-4.142065
other
V12Ag2O30
44
2
843.69
mp-1205255
6.658882
6.04942
-4.381713
other
U4N4O32
40
2
736.1
mp-978990
7.555042
6.594604
-2.965085
other
Tl4I6O18
28
2
486.11
mp-1219592
10.777372
9.32724
-0.781817
other
Sb8Cl2O11
21
2
432.3
mp-1175337
7.007381
19.746126
-0.182577
other
Li7Mn5O12
24
2
220.34
mp-641703
-2.291276
-0.493309
-5.583414
other
Li14P6S22
42
2
876.77
mp-758049
5.594162
10.911118
-0.193091
other
Sr12Fe8O27
47
2
597.71