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-505484
-7.869861
-4.377914
3.639786
other
Pr8Ge8Pt8
24
59
507.1
mp-766059
8.450243
14.877936
-1.1847
other
Na6Mn16O32
54
59
643.51
mp-1411095
12.228145
12.702275
-2.103145
other
Mg2V4O10
16
59
195.09
mp-1345605
12.751895
10.6149
1.926223
other
Ca4Ti8O16
28
59
344.97
mp-17112
-4.897715
-6.30947
2.122993
other
K6Ge8Au2
16
59
486.45
mp-1446443
5.671787
11.209219
-1.670615
other
Ca2Fe4O10
16
59
218.24
mp-1192215
9.498801
1.962721
1.412999
other
Cs4V4F16
24
59
393.14
mp-1192602
-8.620718
-6.351954
2.737778
other
Nd6Sn10Au12
28
59
659.13
mp-1183951
-5.499441
-6.828089
1.88651
other
Cs6Pb8Au2
16
59
733.72
mp-3838
1.341636
2.319631
1.642279
other
Li10Re2N8
20
59
214.67
mp-1377365
7.264012
8.977219
-2.254796
other
Mg4Ag8O16
28
59
389.16
mp-532358
12.873974
10.651744
2.322389
other
Ca6Nb24O48
78
59
999.71
mp-5079
8.390952
1.750691
0.649129
other
K8Sb8F32
48
59
834.53
mp-770995
7.037081
13.509321
-1.932074
other
Co8Hg4O16
28
59
311.83
mp-17401
-5.646957
-6.403646
1.723869
other
Rb6Sn8Au2
16
59
636.8
mp-1193042
-8.506677
-6.209024
2.840898
other
Ce6Sn10Au12
28
59
659.27
mp-30053
4.03867
2.332447
-2.911543
other
Na2C2N2
6
59
99.56
mp-1197357
-5.758996
-0.645241
1.38695
other
Nd6Co18P12
36
59
498.06
mp-27502
4.46733
2.902483
-3.748175
other
C2N2Cl2
6
59
144.67
mp-756732
-5.350832
-6.482333
1.642421
other
Rb6Sn8Au2
16
59
725.37
mp-1345209
8.035985
13.389418
-0.944356
other
Mg4Fe8O16
28
59
312.41
mp-1246923
0.450572
2.461144
1.923761
other
Mn10Cu2N8
20
59
205.76
mp-27989
4.265067
2.898568
-3.673114
other
C2Br2N2
6
59
162.41
mp-546279
10.547256
8.184635
3.099517
other
Sc2Br2O2
6
59
126.11
mp-626113
8.291001
4.221245
-4.643972
other
H8N4O6
18
59
158.24
mp-1247508
0.172002
2.413378
2.074384
other
Mn10Co2N8
20
59
188.83
mp-767588
10.26991
0.315234
-0.19746
other
Li2Mn2F10
14
59
183.63
mp-19111
11.213502
12.523326
-3.339083
other
Na2V4O10
16
59
193.49
mp-3175
10.546663
12.161927
2.437743
other
Ba2Ti8O18
28
59
350.99
mp-608081
-5.760033
-6.978026
2.026963
other
Rb6Pb8Au2
16
59
784.75
mp-1373242
6.132968
12.608555
-1.368908
other
Mg4Ni8O16
28
59
284.77
mp-1373103
6.453312
12.501637
-1.138564
other
Ca4Ni8O16
28
59
313.46
mp-1347880
-4.832042
-0.999278
-5.17989
other
Ca2Mn4S10
16
59
366.42
mp-28314
-5.033094
-6.010868
0.658717
other
Ba14Ga8Sb18
40
59
1,459.47
mp-752629
6.658541
13.727674
-1.975068
other
K4Co8O16
28
59
340.75
mp-1224463
-5.915229
-0.582245
1.46578
other
Ho6Co18P12
36
59
461.09
mp-27841
13.192775
12.435851
-0.870429
other
V2Br2O2
6
59
112.71
mp-1246248
0.596657
2.656086
1.641151
other
Zn2Ni10N8
20
59
219.23
mp-1239184
-5.288003
-0.014894
-5.951391
other
Cr8Hg4S16
28
59
568.94
mp-504771
-6.104721
-0.523693
1.436558
other
La2Co16P10
28
59
343.29
mp-1190523
-8.313144
-4.829832
3.361242
other
Ho8Ge8Pd8
24
59
448.11
mp-1195273
-4.588653
-5.318526
0.560007
other
Ba14Ga8As18
40
59
1,209.08
mp-505467
-5.415861
-4.226144
5.366638
other
Y8Si8Pd8
24
59
449.52
mp-1247470
1.649779
1.655604
1.359286
other
Sr2Ca4N4
10
59
190.63
mp-531365
8.481503
14.860741
-1.174574
other
Li6Mn16O32
54
59
590.54
mp-1201536
-6.192244
-6.271546
1.371597
other
K24Sn8Au42
74
59
2,050.91
mp-1029574
1.502457
2.148732
1.269836
other
Na10Os2N8
20
59
325.49
mp-756173
-4.274306
-1.108412
-5.554966
other
Li10Fe2S8
20
59
365.14
mp-1376718
8.209215
13.326668
-1.115432
other
Zn4Fe8O16
28
59
305.14
mp-1041754
9.633819
8.630564
0.031434
other
Ca4Bi8O16
28
59
506.94
mp-755346
14.125949
5.981009
-2.077217
other
Li10B2O8
20
59
166.48
mp-616615
-5.397854
-3.3269
2.858916
other
Hf16Mn2Te12
30
59
753.21
mp-27863
12.72204
7.720028
0.611845
other
Al2Cl2O2
6
59
90.11
mp-1246995
2.048941
2.156882
1.517475
other
Mg2Zn10N8
20
59
243.47
mp-1376320
12.9672
12.236516
-0.266084
other
Ca4V8O16
28
59
335.44
mp-1246516
0.359572
2.536068
1.866236
other
Co10Ni2N8
20
59
186.28
mp-27850
1.5851
2.255351
2.126009
other
Ti2N2Cl2
6
59
104.23
mp-1181021
7.496755
6.340715
-2.898943
other
Ho2I6O18
26
59
381.26
mp-1247553
0.284413
2.538797
1.868339
other
Sr2Fe10N8
20
59
225.92
mp-1181655
-5.069296
-6.431793
1.386132
other
Cs6Sn8Au2
16
59
792.7
mp-754584
8.184102
9.711707
-0.187239
other
Na10Cu2O8
20
59
290.67
mp-783905
12.752789
13.29975
-0.988569
other
Na4V8O16
28
59
327.7
mp-1193900
-6.094609
-0.534721
1.437274
other
Pr2Co16P10
28
59
341.43
mp-1392223
9.439864
9.471588
-0.036308
other
Ca2Sn4O10
16
59
247.01
mp-1393223
5.715569
11.177761
-1.896165
other
Mg2Fe4O10
16
59
194.25
mp-1337045
-4.820603
-0.948827
-4.870041
other
Ca2Fe4S10
16
59
331.47
mp-1367014
12.406924
10.808405
-1.965782
other
Zn2Mo4O10
16
59
308.89
mp-542565
-6.470608
-4.510089
0.64537
other
Nd6Sb10Pd12
28
59
610.96
mp-1071956
2.221121
2.424355
2.220377
other
Ti2N2F2
6
59
95.54
mp-676518
-5.910292
-3.613437
-2.241106
other
In6Sb2Te4
12
59
470.98
mp-754978
7.99357
10.527164
-0.436218
other
Cd2Cu4O6
12
59
145.63
mp-1193508
7.421974
6.490867
-3.153555
other
Pr2I6O18
26
59
383.72
mp-18934
11.119025
12.691304
-3.504988
other
Li2V4O10
16
59
196.74
mp-754526
10.706498
7.990767
2.724171
other
Tm2Br2O2
6
59
140.2
mp-1378442
11.297821
13.075202
-0.10469
other
Zn4Cr8O16
28
59
311.35
mp-19305
12.272451
12.181678
-1.922813
other
Ca2V4O10
16
59
200.75
mp-1042144
12.909985
10.599575
-0.053662
other
Zn4Mo8O16
28
59
372.38
mp-1077563
-6.264158
-2.366193
-0.359905
other
Co2Te2Mo2
6
59
107.8
mp-1191025
-6.989206
-3.149456
4.872349
other
Zr6Mn4Ga12
22
59
365.1
mp-1191970
5.671315
-0.315614
-3.148187
other
Na2B6H16
24
59
237.85
mp-752958
14.839942
12.062108
-0.841723
other
V4O4F4
12
59
131.96
mp-634429
8.54762
3.257571
-4.613564
other
H8N4O6
18
59
143.93
mp-531914
11.993717
12.338463
1.852339
other
Li6Ti16O32
54
59
606.9
mp-607848
-8.155396
-5.032399
4.026477
other
La2In12Ni6
20
59
405
mp-1197872
-5.900186
-0.575607
1.470184
other
Er6Co18P12
36
59
467.38
mp-1291942
5.947776
11.012355
0.268865
other
Sr8Co4O16
28
59
378.75
mp-1177079
11.037616
11.695068
3.035751
other
Li10Ta24O64
98
59
1,186.7
mp-1246773
2.176006
2.182858
1.537752
other
Mg10Zn2N8
20
59
250.42
mp-505483
-7.953502
-4.307615
3.596466
other
Sm8Ge8Pt8
24
59
484.29
mp-510725
12.305036
12.199197
-2.068725
other
Sr2V6O14
22
59
296.93
mp-22998
-4.533025
0.129166
-5.77082
other
Cr2S2Br2
6
59
141.33
mp-1246541
1.937439
2.336347
1.251288
other
Zn2Pb4N4
10
59
276.69
mp-1103009
2.568569
2.896688
-4.018104
other
Hg4N4Cl4
12
59
368.04
mp-867370
-8.61693
-6.335221
2.736681
other
Pr6Sn10Au12
28
59
652.11
mp-17830
-4.712793
-6.231698
1.946351
other
Rb6Ge8Au2
16
59
531.64
mp-1178295
8.666033
4.120982
-1.212646
other
Fe8O10F6
24
59
272.9
mp-752637
10.653716
7.909698
2.668627
other
Ho2Br2O2
6
59
146.56
mp-28929
-2.148249
-1.606286
-4.414635
other
Dy2S2I2
6
59
214.97
mp-1346425
-5.068836
-0.821681
-5.214094
other
Mn4Zn2S10
16
59
318.85
mp-1191713
-6.839793
-3.19985
4.780273
other
Hf6V4Ga12
22
59
370.55