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-1111431
8.442237
1.259657
0.819833
other
K2Rb1Ru1F6
10
225
198.75
mp-1111821
1.258097
2.392426
-5.993244
other
Cs2Na1Nd1Cl6
10
225
339.93
mp-989399
-5.120127
-6.822563
3.433596
other
Ca6Al2N1F1
10
225
239.31
mp-1520549
7.444922
8.739717
0.300504
other
Tb1Eu2Sn1O6
10
225
151.07
mp-989572
8.208333
0.88844
0.720578
other
Cs2Na1Ca1F6
10
225
197.55
mp-1205713
10.897942
8.815687
2.459462
other
Ba2Y1U1O6
10
225
171.73
mp-1113292
1.445059
2.63798
-5.854602
other
Cs2Tl1Hg1Cl6
10
225
331.49
mp-1111107
8.916212
1.632578
1.578872
other
K2Li1Ti1F6
10
225
137.66
mp-13815
8.120756
0.793632
1.802165
other
Rb2Na1Er1F6
10
225
179.81
mp-546339
5.932865
8.856239
-0.685508
other
Tb1Mn2Bi1O6
10
225
153.55
mp-1112257
8.525908
1.438261
0.811097
other
K2Ru1Au1F6
10
225
175.48
mp-1111240
-0.561801
1.243052
-4.355615
other
K2Na1As1Br6
10
225
341.98
mp-1111100
8.956413
1.240594
1.053045
other
Li2In1Cu1F6
10
225
150.64
mp-1113640
1.215439
2.367247
-5.872675
other
Rb2Sm1Au1Cl6
10
225
323.07
mp-1205507
9.984669
11.442803
0.906246
other
Eu2Mg1W1O6
10
225
128.33
mp-1111727
1.199937
2.332501
-5.809173
other
Rb2La1Ag1Cl6
10
225
335.41
mp-1110856
1.388847
2.493005
-5.713047
other
K2Cu1Sb1Cl6
10
225
277.45
mp-1110632
-0.643969
1.263563
-4.459177
other
Rb2In1As1Br6
10
225
372.25
mp-1214622
9.504553
9.697143
3.542295
other
Ba2Sm1Ta1O6
10
225
161.65
mp-1205520
9.928709
9.817163
3.663877
other
Eu2Dy1Ta1O6
10
225
148.42
mp-1080023
11.605109
10.697444
-0.156335
other
Mo1Os1Pb2O6
10
225
135.53
mp-1110698
-0.6094
0.94815
-4.054371
other
Rb2Na1Ta1Br6
10
225
339.97
mp-1111537
-0.509642
1.192086
-4.277274
other
Na2Ga1Ag1Br6
10
225
309.19
mp-1206062
10.047845
8.698349
3.161706
other
Ba2Pr1Pa1O6
10
225
186.66
mp-1112902
1.431537
2.669427
-5.860025
other
Cs2Hg1Sb1Cl6
10
225
348.81
mp-1522904
7.621887
8.586394
0.527447
other
K1Eu1Zr2O6
10
225
147.2
mp-1205582
8.900707
10.81312
1.19639
other
Sr2Cr1Os1O6
10
225
124.32
mp-1111068
1.538876
2.456517
-5.222962
other
Na2Hg1As1Cl6
10
225
297.83
mp-1111738
-0.349769
1.28616
-4.332083
other
Na2Li1Tl1Br6
10
225
324.35
mp-545735
7.904802
10.238597
1.636791
other
Ba2Nd1Ru1O6
10
225
159.13
mp-1111352
8.722296
1.314766
1.227243
other
Li2Al1Hg1F6
10
225
158.03
mp-1113963
1.221107
2.159795
-5.693679
other
Rb2Na1Sc1Cl6
10
225
279.71
mp-1147688
8.1871
10.183164
-0.314889
other
Ba1In1Cu6O8
16
225
207.22
mp-1111127
1.430774
2.458304
-5.694518
other
K2Na1Ga1Cl6
10
225
270.2
mp-1206292
10.905399
8.784828
2.480505
other
Ba2Er1U1O6
10
225
168.27
mp-1112087
1.141972
2.198428
-5.704
other
K2Sm1Ag1Cl6
10
225
318.16
mp-1113945
1.649561
2.590731
-5.362773
other
Na2Li1Au1Cl6
10
225
248.46
mp-13932
10.476462
10.287864
1.509879
other
Ba2Dy1Re1O6
10
225
152.14
mp-989541
8.225119
1.258114
1.126808
other
Rb2Na1Sb1F6
10
225
186.14
mp-1111733
1.194819
2.307037
-5.802368
other
Rb2Dy1Ag1Cl6
10
225
311.86
mp-1114036
1.252026
2.310332
-5.855997
other
K1Rb2Sc1Cl6
10
225
330.83
mp-1111205
1.137186
2.236968
-5.793518
other
K2Rb1Tb1Cl6
10
225
380
mp-1111461
1.484717
2.681211
-5.918353
other
Cs2Cu1Sb1Cl6
10
225
290.21
mp-1079391
6.587594
10.536476
0.899145
other
Sr2La1Cr1O6
10
225
148.34
mp-1520112
8.38238
11.379188
1.307762
other
Tb1Eu2V1O6
10
225
139.67
mp-1205639
9.121154
8.817957
2.866298
other
Ba2Yb1Pa1O6
10
225
171.46
mp-1078912
6.050606
10.252687
0.352468
other
Sr4Hf2Fe2O12
20
225
260.66
mp-1112309
1.240107
2.368843
-5.920932
other
Cs1K2Sc1Cl6
10
225
376.77
mp-24412
3.469411
-0.66854
-2.46641
other
K2Na1Al1H6
10
225
129.35
mp-1112002
1.473096
2.642678
-5.870141
other
Cs2Tl1Ga1Cl6
10
225
329.61
mp-1522139
9.956689
9.783695
3.98953
other
Ca2Hf1Zr1O6
10
225
141.19
mp-1114305
8.422277
1.114715
0.790134
other
Cs2Ag1As1F6
10
225
194.37
mp-1112630
-0.423287
1.018482
-4.616529
other
Cs2Sc1Hg1Br6
10
225
379.02
mp-1111277
9.074025
1.345428
1.276781
other
Na2Ga1Cu1F6
10
225
136.81
mp-504674
9.85971
10.557
1.283014
other
Ba2Eu1Re1O6
10
225
158.32
mp-1516449
9.993645
10.202955
1.494103
other
Eu2Cr1Sb1O6
10
225
128.7
mp-989582
-5.333555
-7.015563
3.288432
other
Ca6Pb2Se1N1
10
225
281.82
mp-1517204
9.88804
9.67762
3.753045
other
Sr2Dy1Nb1O6
10
225
150.62
mp-1111245
-1.237029
2.288171
-2.475754
other
K2Li1Ta1I6
10
225
392.18
mp-1112889
1.367861
2.728415
-5.955927
other
Cs2In1Bi1Cl6
10
225
377.9
mp-1079925
6.52667
10.423757
0.759314
other
Sr2Y1Cr1O6
10
225
137.95
mp-1113764
8.353348
1.07586
0.679626
other
K1Rb2Ir1F6
10
225
189.9
mp-1205690
10.14861
10.949491
2.92018
other
Sr8Nb4Cr4O24
40
225
515.1
mp-1110655
8.367845
1.1076
1.881439
other
Rb2Li1Ce1F6
10
225
175.78
mp-1112155
-1.243193
3.174842
-3.042298
other
Cs2Rb1Ga1I6
10
225
505.09
mp-1111089
8.522896
1.573614
0.863964
other
Na2As1Au1F6
10
225
177.53
mp-1111620
1.302545
2.420207
-5.814648
other
Rb2Sc1Au1Cl6
10
225
290.31
mp-1516495
11.682304
9.852924
2.884681
other
Eu2Zr1Nb1O6
10
225
141.51
mp-1114078
1.162254
2.255725
-5.772569
other
Rb2Y1Hg1Cl6
10
225
347.7
mp-1111667
1.452046
2.417526
-5.272492
other
Na2Al1Hg1Cl6
10
225
279.27
mp-1112893
-0.650368
1.327719
-4.602349
other
Cs2In1As1Br6
10
225
381.42
mp-556353
8.979628
0.308928
0.273315
other
Rb2Na1Ni1F6
10
225
154.56
mp-1113607
1.331956
2.626289
-5.886998
other
Cs1Rb2In1Cl6
10
225
386.32
mp-1113900
8.671243
1.057318
1.65794
other
Na2Li1Sc1F6
10
225
129.68
mp-13898
8.218943
0.647757
1.212502
other
Cs2Na1In1F6
10
225
174.66
mp-1110996
8.554918
1.202654
1.4868
other
Na2Y1Cu1F6
10
225
166.75
mp-1517558
11.329841
10.438073
1.048328
other
Sr2Sm1W1O6
10
225
154.36
mp-1523324
6.474424
11.100244
1.033289
other
Sr2Mn1Sn1O6
10
225
126.84
mp-1114120
-0.417804
1.037132
-4.41462
other
K1Rb2Sc1Br6
10
225
389.86
mp-1114000
1.240029
2.361264
-5.841323
other
Rb2Y1Tl1Cl6
10
225
373.97
mp-1113980
1.179541
2.193174
-5.728237
other
Rb2Li1Dy1Cl6
10
225
286.99
mp-1111002
8.153749
0.920597
1.60918
other
Rb2Sc1Hg1F6
10
225
198.24
mp-1110718
-1.329691
2.511198
-2.514575
other
Rb2Ta1Cu1I6
10
225
379.73
mp-1112227
1.117154
2.063359
-5.62537
other
K2Nd1Cu1Cl6
10
225
291.32
mp-556757
9.098524
0.353899
0.220253
other
K2Na1Ni1F6
10
225
145.19
mp-1207215
9.950237
9.623804
3.709149
other
Sr2Nd1Nb1O6
10
225
159.89
mp-1095170
8.185251
10.857787
1.15869
other
Sr4Fe2Os2O12
20
225
252.32
mp-1111835
-0.533047
1.253686
-4.710366
other
Cs2Li1Sb1Br6
10
225
356.79
mp-1111711
1.253375
2.396888
-5.883301
other
Rb2Y1Au1Cl6
10
225
314.13
mp-1112139
-1.264959
3.079955
-2.948435
other
Cs2Na1Tl1I6
10
225
475.96
mp-1110807
-0.403861
1.050194
-4.34969
other
Rb2Nd1Ag1Br6
10
225
380.15
mp-1227741
12.143309
10.630219
0.489525
other
Ba1Sr1Mo2O6
10
225
139.56
mp-1111820
1.242318
2.370445
-5.983038
other
Cs2Na1Pr1Cl6
10
225
343.95
mp-1113344
-0.644896
0.955428
-4.017863
other
Rb2Ta1Cu1Br6
10
225
305.32
mp-1111341
8.916634
1.587751
0.952967
other
Na1Li2Ru1F6
10
225
143.22
mp-1112793
-1.21248
2.970447
-3.00553
other
Cs2K1As1I6
10
225
496.15
mp-1205927
8.038179
2.204589
-1.018376
other
Na1Tl1N2F6
10
225
173.5
mp-1113928
1.232793
2.208986
-5.701372
other
Rb2Li1Sc1Cl6
10
225
267.83
mp-1111099
9.425783
0.612125
0.195505
other
Li2Co1Ag1F6
10
225
142.18
mp-1519666
9.775105
9.17716
3.789499
other
Sr2Ce1Zr1O6
10
225
160.57