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-1175428
4.618457
19.008873
-1.786361
other
Li9Co7O16
32
2
276.83
mp-1643829
9.726083
12.744116
-0.227162
other
Li16Fe10O20
46
2
522.32
mp-725936
6.844783
8.417308
-2.838887
other
Ba2Al4O16
22
2
353.24
mp-541102
-1.101256
1.358695
-1.786538
other
Sc12C4I22
38
2
1,240.49
mp-674388
6.176682
13.574886
-2.430078
other
Li1Co8O16
25
2
271.74
mp-757877
12.520991
13.135478
-1.180212
other
V12Ga6O30
48
2
517.82
mp-1020179
11.755802
6.527046
-0.764191
other
Na48Si16O56
120
2
1,618.69
mp-1247325
1.532531
1.921712
1.338996
other
Ca8Pt2N8
18
2
279.66
mp-1029869
1.060268
2.608166
1.630329
other
K30Mo14N38
82
2
1,664.54
mp-557829
10.47297
9.311728
-1.966061
other
Lu4Te10O26
40
2
591.74
mp-31998
10.696012
8.099228
-7.213815
other
Mn2P8O24
34
2
452.61
mp-1245997
2.25549
2.227798
1.466798
other
Cd6Ga6N10
22
2
316.65
mp-623088
8.203108
1.290159
0.273676
other
K6Tb6F30
42
2
645.35
mp-19334
10.655124
11.580338
-0.622128
other
Na8W2O10
20
2
236.33
mp-1207999
-7.885219
-3.845467
4.494589
other
Tm4Al24Pt9
37
2
618.62
mp-1407342
8.490874
11.177773
0.049264
other
Ca4Ni4O8
16
2
209.26
mp-1335659
7.004619
5.670246
-3.073409
other
Pr2N6O30
38
2
631.58
mp-31073
13.800286
4.134205
-2.337877
other
Na6B14O24
44
2
464.44
mp-1175409
6.613054
14.760118
-1.586307
other
Li9Co7O16
32
2
251.77
mp-645425
-0.992896
0.941001
-1.619236
other
Pr14C6I20
40
2
1,398.7
mp-1180738
6.865855
5.976196
-3.453756
other
La2Br6O14
22
2
409.61
mp-768524
12.028889
7.642416
-2.937847
other
Ge8As8O28
44
2
681.02
mp-769271
10.231333
10.274359
3.526858
other
Sr8Ta4O18
30
2
486.2
mp-1371409
11.183927
11.69104
0.228896
other
Mn4Zn4O8
16
2
208.6
mp-759564
12.187922
11.03431
-1.227763
other
Na7W9O27
43
2
519.57
mp-29303
-3.602193
-1.528008
-5.713449
other
Tl8Sn10S24
42
2
1,146.2
mp-760204
6.185429
12.733448
-1.318645
other
Na8Ni9O18
35
2
347.52
mp-776128
10.190845
2.29624
0.549729
other
Li6V8F38
52
2
623.74
mp-1105273
-0.474949
1.096296
-4.478165
other
Cs2Bi4Br14
20
2
753.77
mp-28863
-1.03199
1.299048
-1.746804
other
Y6Os1I10
17
2
652.47
mp-650121
8.646907
6.793726
-3.842185
other
Li12Se6O24
42
2
622.03
mp-1219344
-7.713277
1.078972
5.00393
other
Sm4Fe34C3
41
2
537.96
mp-542131
-4.49621
-1.938733
-2.400476
other
U4Te16Br20
40
2
1,483.05
mp-753745
13.31613
8.271823
-7.154627
other
Cr4P4O16
24
2
310.34
mp-574822
4.466109
2.243082
-3.227325
other
Na2C8N6
16
2
263.76
mp-1175317
7.019097
19.63106
-0.187193
other
Li14Mn10O24
48
2
441.41
mp-1194329
9.585547
9.58245
-2.070071
other
Fe4Te6O20
30
2
484.91
mp-1246429
2.359864
2.230795
1.665238
other
Ga6Ge6N10
22
2
313.97
mp-2237154
10.773164
8.138085
-2.663628
other
Cr2Ge4O12
18
2
231.27
mp-752908
6.97409
13.282332
-1.095242
other
Li6Ni5O10
21
2
190.92
mp-690528
6.126441
13.369513
-1.411753
other
Li7Ni8O16
31
2
264.4
mp-1013760
-3.521454
-1.591125
-5.65293
other
Sn10S8Cl4
22
2
591.28
mp-695001
-6.23998
-2.544228
-1.915644
other
V12Cu10Te24
46
2
1,083.67
mp-1247297
0.894489
2.301306
1.690574
other
Ba6Mn6N10
22
2
361.39
mp-753454
8.096358
12.162898
-0.859864
other
Zn1Ni9O10
20
2
190.82
mp-5572
10.469962
9.329947
-1.982913
other
Ho4Te10O26
40
2
608.64
mp-1205323
-1.178364
1.275964
-1.657992
other
Tb6Os1I10
17
2
654.16
mp-1211757
8.192062
10.167555
0.008276
other
K16Mn4O16
36
2
653.87
mp-754731
5.195456
11.610245
-2.34151
other
Fe6O10F2
18
2
194.81
mp-555063
11.714519
7.891168
-2.409902
other
Nd4As8O18
30
2
470.66
mp-761161
10.235594
0.943615
1.561677
other
Li6Mn2F10
18
2
196.23
mp-685374
10.895308
13.015388
-0.275248
other
Ti6Fe10O24
40
2
428.3
mp-1639253
7.309209
13.071009
-1.09251
other
Li4Ni8O12
24
2
214.63
mp-775737
7.961824
12.46884
-0.901151
other
Li1Ni9O10
20
2
184.16
mp-1180306
6.8434
6.310452
-3.976818
other
Na3Np1O10
14
2
214.17
mp-766124
9.821215
12.225007
-4.184245
other
Ba2V16O42
60
2
836.7
mp-1210621
1.399094
2.232459
-5.541986
other
Na2Eu2Cl8
12
2
338.6
mp-863288
7.624631
7.928874
-4.218331
other
Na6V10O46
62
2
933.58
mp-1175429
4.312241
19.298742
-1.828737
other
Li9Co7O16
32
2
284.48
mp-1179646
-5.590899
1.350007
-4.855991
other
Sn1Mo6S8
15
2
279.04
mp-555940
10.469293
9.286794
-2.010301
other
Dy4Te10O26
40
2
613.14
mp-1264966
8.295937
13.162332
-0.985897
other
Al4Fe4O12
20
2
197.56
mp-1192800
6.542258
6.041004
-3.79105
other
Pr2Cl6O14
22
2
435.48
mp-765679
6.098718
12.693974
-1.341319
other
Na5Ni6O12
23
2
230.12
mp-1204428
6.24481
5.509237
-4.367079
other
Eu2N6O28
36
2
572.12
mp-1213671
8.321767
2.194076
-0.417607
other
Cu1Sn3F6
10
2
2,366.36
mp-1214773
7.774807
2.405006
-1.071569
other
As1N3F6
10
2
362.9
mp-1659341
8.472523
12.02731
0.314712
other
Y8Cr12O36
56
2
647.73
mp-619791
0.756999
1.202731
-3.82327
other
La10C4Cl18
32
2
795.83
mp-766168
10.477199
12.335346
1.751873
other
Ti8Sn2O20
30
2
333.63
mp-1648171
7.051245
19.541414
-0.19226
other
Li14Mn10O24
48
2
443.95
mp-1246547
0.69384
2.823141
1.683683
other
Co4Mo4N12
20
2
370.46
mp-759507
10.910407
-0.116309
0.08977
other
Mn12O4F32
48
2
603.63
mp-1367812
7.671681
5.465356
-1.857212
other
Mg4Mn6O14
24
2
265.78
mp-554328
8.916783
5.31359
-5.771795
other
Na2S2O8
12
2
161.83
mp-1178299
5.234096
11.798244
-2.39149
other
Fe10O16F4
30
2
326.6
mp-569060
-4.3574
-2.564646
-3.384586
other
Cs4P2Se10
16
2
587.29
mp-1173972
6.797682
19.880455
-0.259496
other
Li6Mn4O10
20
2
181.55
mp-1100529
7.141893
19.613186
-0.121017
other
Li9Mn7O16
32
2
297.73
mp-1192964
6.174157
5.294908
-4.526662
other
Y2N6O20
28
2
384.74
mp-765675
6.831842
12.784631
-1.232299
other
Na4Ni6O10
20
2
197.36
mp-769473
6.051186
13.173072
-1.530003
other
Li13Ni9O22
44
2
368.06
mp-22325
12.571881
6.409696
-5.369125
other
P8Pb8O28
44
2
618.26
mp-690170
12.642394
12.483377
-1.457421
other
Yb2V8O16
26
2
342.04
mp-675532
12.482535
11.347475
2.111953
other
La2Ti12O24
38
2
423.84
mp-1232516
-2.718289
-0.287171
-5.326786
other
Mn4P4S12
20
2
445.11
mp-1201984
7.347272
7.240243
-4.320063
other
V10Ni2O46
58
2
886.8
mp-863767
10.746618
12.599952
-0.585479
other
Fe26Sn4O40
70
2
802.31
mp-761075
12.667677
7.382585
-6.990015
other
Ni4P16O44
64
2
804.8
mp-1208787
5.599422
2.263852
-3.130728
other
Ti6C140Cl26
172
2
2,409.82
mp-2227548
8.641726
10.909369
-0.118039
other
Mg1Cu2O2
5
2
78.85
mp-3283
11.039903
11.298623
2.781666
other
Rb4Nb4O12
20
2
354.33
mp-1245944
-0.023771
2.458612
2.123192
other
V2Fe8N8
18
2
167.77
mp-2215871
12.669234
12.691509
-1.361528
other
Mg1V4O8
13
2
151.77
mp-796008
7.992443
3.966998
-1.197184
other
Mn1Sb2F12
15
2
236.84
mp-1215862
10.131757
9.613019
-0.204375
other
Zn14Sb4O24
42
2
499.84
mp-1198471
6.890556
6.686227
-3.707035
other
Sr2I4O30
36
2
707.34
mp-776037
10.166999
12.637898
-3.937441
other
Li6V24O60
90
2
1,130.98
mp-1100852
12.598845
12.289526
-1.594895
other
Yb2V8O16
26
2
347.51
mp-28904
10.346904
9.22251
-2.045757
other
Na4Te8O18
30
2
461.94