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-1209442
6.939084
6.636062
-3.703116
other
Sm14Br6O36
56
176
903.57
mp-1180833
7.275365
5.907251
-4.466626
other
La4S6O42
52
176
780.01
mp-1245608
1.849027
2.350553
1.043655
other
Co2Pb6N6
14
176
343.51
mp-24645
11.349578
4.057888
-3.484691
other
Er2H6O6
14
176
120.81
mp-1208610
13.3818
5.209122
-6.237652
other
Sr10P6O26
42
176
604.78
mp-1192906
9.73389
10.163473
3.356844
other
Ba8Ta4O18
30
176
539.63
mp-28752
11.115574
11.719497
2.833155
other
Ta14Cu6O38
58
176
699.38
mp-625402
11.244616
4.232571
-3.345025
other
Sm2H6O6
14
176
127.61
mp-1189526
7.934117
7.94418
-2.556301
other
Mg6B2O12
20
176
229.95
mp-16981
12.069371
7.706378
0.547112
other
Sm10Si6O26
42
176
559.82
mp-1211372
7.890411
7.199025
-4.221029
other
La2Se6O24
32
176
533.18
mp-1029531
1.434106
1.912341
1.457993
other
Sr6Re2N6
14
176
288.2
mp-1246803
2.017922
2.32572
1.382922
other
Cr2Sn6N6
14
176
305.94
mp-1246468
1.705438
1.706755
1.37649
other
Ba6B2N6
14
176
327.02
mp-1029686
1.323778
1.840925
1.562509
other
Sr6Os2N6
14
176
279.76
mp-1247011
1.120632
2.422518
1.656463
other
Zn6Fe2N6
14
176
204.64
mp-1219766
-6.088677
1.387541
-4.719345
other
Rb2Mo18S18
38
176
933.46
mp-24073
11.114824
4.131733
-3.421786
other
Gd2H6O6
14
176
124.8
mp-1246178
1.396261
1.892762
1.326692
other
Ba6W2N6
14
176
352.69
mp-28968
-5.366328
-2.038124
-1.387641
other
Nb6Te6As2
14
176
343.58
mp-768419
6.459804
5.879473
-3.574622
other
La2Cl6O24
32
176
450.35
mp-1029655
1.381805
1.996079
1.483572
other
Sr6W2N6
14
176
292.73
mp-1103933
-7.071111
1.440562
-4.28783
other
Li2Mo6Se6
14
176
316.48
mp-24074
11.31331
4.08205
-3.398443
other
Dy2H6O6
14
176
119.14
mp-561150
6.461528
6.18889
-3.702628
other
Yb2Cl6O24
32
176
452.74
mp-1246448
1.286345
1.963796
1.513637
other
Sr6Mo2N6
14
176
295.42
mp-1214077
8.438962
7.759098
-2.320359
other
Ca10Si6O26
42
176
563.69
mp-1246753
0.661352
2.631709
1.778248
other
Mn6In2N6
14
176
196.68
mp-1104001
-7.005084
1.062293
-4.166086
other
Ba2Mo6Se6
14
176
324.88
mp-27477
8.463482
2.333285
-0.802754
other
Tc6O6F24
36
176
545.64
mp-613455
9.101072
9.837051
-3.654662
other
Yb2Re6O24
32
176
566.84
mp-727115
12.925369
5.601009
-5.800212
other
Ba10P6O26
42
176
700.56
mp-1246810
1.303975
1.865073
1.331515
other
Ba6Mo2N6
14
176
352.76
mp-1029943
1.906464
1.814886
1.419013
other
Ca6Ga2N6
14
176
225.66
mp-1208729
-5.765115
-1.542469
0.80225
other
Y30Ni56P42
128
176
1,912.27
mp-1212141
6.998219
7.706035
-2.9747
other
La14Br6O36
56
176
983.95
mp-625394
11.131043
4.253569
-3.2998
other
La2H6O6
14
176
141.44
mp-1207720
6.467081
5.868467
-3.580164
other
Y2Cl6O24
32
176
439.64
mp-27506
1.418728
2.879135
-5.06897
other
K6W4Cl18
28
176
742.84
mp-1214218
11.367482
7.144162
-4.17665
other
Ca10As6O28
44
176
599.79
mp-1245686
1.664548
1.809565
1.439254
other
Sr6Ti2N6
14
176
289.56
mp-1246302
1.39016
1.91279
1.511022
other
Sr6V2N6
14
176
277.33
mp-769148
6.523648
5.898632
-3.642223
other
Sc2Cl6O24
32
176
399.97
mp-1247360
1.729369
1.824483
1.192766
other
Ca6In2N6
14
176
246.46
mp-1246737
1.623032
1.84976
1.178791
other
Sr6Bi2N6
14
176
312
mp-1213341
7.118118
8.52202
-1.828642
other
Gd14Br6O36
56
176
953.66
mp-1104242
-7.095626
1.443997
-4.264666
other
K2Mo6Se6
14
176
329.31
mp-562471
6.508843
13.256216
-1.770707
other
K8Co14O28
50
176
676.9
mp-28827
-2.523792
0.693698
2.448988
other
Tb6Mn4C12
22
176
284.7
mp-581739
-7.053267
1.452805
-4.306179
other
Cs10Mo42Se46
98
176
2,556.99
mp-554758
13.103372
6.211578
-6.741982
other
Si2P4O14
20
176
230.81
mp-1245891
1.732388
1.776075
1.420695
other
Sr6Sc2N6
14
176
297.69
mp-568072
-6.957743
1.383071
-4.198864
other
Rb10Mo54Se62
126
176
3,099.1
mp-1103685
-7.108712
1.394191
-4.202588
other
Rb2Mo6Se6
14
176
345.16
mp-1212938
11.11744
6.269671
-2.260557
other
Dy10B6O26
42
176
468.74
mp-1212707
-7.06909
-1.050386
4.413534
other
Ho6Co30Si18
54
176
672.78
mp-725923
10.475854
12.265989
-3.458441
other
Ca10V6O26
42
176
601.05
mp-1247428
1.413423
1.919976
1.479428
other
Ca6Re2N6
14
176
242.98
mp-1245831
1.595832
1.801232
1.241543
other
Ba6Sc2N6
14
176
359.54
mp-1245483
0.594463
2.619209
1.662244
other
Mn2Ni6N6
14
176
164.63
mp-1182901
12.794401
5.292402
-2.645017
other
Al12B10O36
58
176
640.69
mp-1247449
1.576323
1.793061
1.481756
other
Sr6Ta2N6
14
176
302.53
mp-1246500
1.633081
1.826795
1.230998
other
Ca6Cu2N6
14
176
224.76
mp-21748
-7.495668
-2.455453
4.337755
other
Tb6Si18Rh30
54
176
825.25
mp-569882
-6.91238
-1.235775
4.47072
other
U12Co60Si38
110
176
1,385.1
mp-1212615
10.770585
7.799675
-1.765869
other
Ge6Pb10O24
40
176
665.98
mp-8306
1.438639
1.808979
1.258367
other
Ba6Fe2N6
14
176
320.61
mp-29218
11.294276
7.437267
-1.241385
other
Ge6Bi4O18
28
176
416.71
mp-35644
1.515364
1.839845
1.229671
other
Sr6Fe2N6
14
176
266.02
mp-755446
9.715022
6.832043
-3.562102
other
Bi4B6O18
28
176
318.14
mp-620069
1.500584
2.844185
-5.09697
other
K6Mo4Cl18
28
176
745.3
mp-18846
6.564028
13.91661
-1.964709
other
Na8Co14O28
50
176
542.81
mp-627640
6.375553
6.032301
-3.611611
other
Eu2Cl6O24
32
176
432.23
mp-12905
1.403539
1.794363
1.390335
other
Ba6Cr2N6
14
176
330.96
mp-1246731
1.557037
1.864458
1.383073
other
Sr6Co2N6
14
176
263.41
mp-1209931
-6.199192
-3.989489
0.791645
other
Nd6Fe6Sb14
26
176
648.32
mp-1192931
6.61562
6.037261
-3.612881
other
Ba2Cl4O22
28
176
463.55
mp-1103583
-6.961467
1.350382
-4.303586
other
Tl2Mo6Se6
14
176
383.73
mp-1247344
1.773902
1.74693
1.450676
other
Ca6Sc2N6
14
176
248.89
mp-24076
11.309892
4.127445
-3.392077
other
Y2H6O6
14
176
124.57
mp-31067
6.488494
5.87772
-3.553777
other
Nd2Cl6O24
32
176
434.09
mp-31065
9.550251
6.985518
-3.537095
other
Sc4Se6O18
28
176
441.5
mp-768147
6.455689
5.885211
-3.564459
other
Dy2Cl6O24
32
176
428.25
mp-649833
-5.748614
-1.594414
0.851719
other
Tb30Ni56P42
128
176
1,917.6
mp-1104518
-7.05437
1.395884
-4.310107
other
In2Mo6Se6
14
176
371.84
mp-1204126
7.469425
9.084898
-3.8388
other
Cr18N12O60
90
176
1,848.38
mp-13861
-8.282241
-0.539849
4.168561
other
Hf2B8Ir6
16
176
175.23
mp-569462
-5.104991
-4.388178
6.111525
other
Pr30Si20Ni14
64
176
1,497.87
mp-1208075
-7.040982
-1.039275
4.431074
other
Y6Co30Si18
54
176
689.91
mp-1186069
-6.934095
1.333696
-4.187147
other
Na2Mo6Se6
14
176
299.24
mp-1197201
-5.907732
1.565457
-4.779018
other
Sn4Mo30S38
72
176
1,456.89
mp-975237
-8.799428
1.599115
-3.297239
other
Rb2Te6Mo6
14
176
402.45
mp-626413
8.389524
7.366294
-3.626466
other
Yb2H6O6
14
176
121.33
mp-1198238
-7.078399
-1.085355
4.421805
other
Er6Co30Si18
54
176
678.55
mp-22830
-7.510789
-2.451378
4.358399
other
Dy6Si18Rh30
54
176
823.57
mp-1246503
1.82288
2.432795
0.873082
other
Mn2Pb6N6
14
176
270.39
mp-1247491
1.492561
2.272528
1.125288
other
K6Re2N6
14
176
347.68
mp-772098
6.450918
5.876575
-3.552385
other
Sm2Cl6O24
32
176
443.67
mp-1029537
1.488179
1.868859
1.313826
other
Ba6Ru2N6
14
176
331.33
mp-16096
-8.672118
1.561173
-3.302443
other
Tl2Te6Mo6
14
176
373.2