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-1206768
1.440446
2.555187
-5.672785
other
Rb2Na1V1Cl6
10
225
275.47
mp-1080470
8.694123
10.234937
1.621805
other
Ba2Sm1Os1O6
10
225
156.66
mp-1521426
5.847312
10.465236
-0.132745
other
Sr2Tb1Ni1O6
10
225
132.85
mp-1523371
11.935156
10.384365
1.450892
other
Sr2Hf1W1O6
10
225
139.6
mp-1110709
-0.365572
1.089463
-4.330698
other
Rb2Li1Pr1Br6
10
225
360.88
mp-1111065
8.802147
1.360358
1.631926
other
Na2Sc1Cu1F6
10
225
148.07
mp-1114188
-1.27043
2.703383
-2.547277
other
Rb2Sc1In1I6
10
225
481.84
mp-1111303
9.263658
0.706349
0.809824
other
Na2Mn1Au1F6
10
225
161.15
mp-1218683
8.385213
11.525262
2.359378
other
Sr2Ta1Mn1O6
10
225
129.69
mp-1519559
7.414662
8.40978
0.833349
other
Ba2Pr1Zr1O6
10
225
174.94
mp-1517644
12.260329
10.379713
1.393278
other
Sr2Nb1W1O6
10
225
140.02
mp-989605
8.140802
0.590568
1.16821
other
Cs2Rb1In1F6
10
225
223.86
mp-1111713
-0.472357
1.281302
-4.572087
other
Rb2Tl1Au1Br6
10
225
357.03
mp-1110998
9.037619
1.703308
1.047828
other
Na2Li1As1F6
10
225
133.6
mp-1110755
1.117318
2.220495
-5.786239
other
K2Rb1Pr1Cl6
10
225
401.55
mp-1218224
5.944937
11.658519
0.590498
other
Sr1La1Co2O6
10
225
111.08
mp-989583
1.370486
2.535146
-5.754235
other
Rb2Li1In1Cl6
10
225
274.55
mp-1080434
5.758928
10.664232
-0.016083
other
Sr8Y4Co4O24
40
225
534.69
mp-1209491
-0.398488
0.7275
-3.854546
other
Rb8Zr6Be1Br20
35
225
1,238.84
mp-1206761
10.012748
9.604253
3.590235
other
Sr2La1Nb1O6
10
225
163.92
mp-13687
8.29071
0.776059
0.341201
other
Cs2K1Ag1F6
10
225
208.12
mp-1111780
1.203659
2.430435
-5.954605
other
Cs1Rb2Gd1Cl6
10
225
418.59
mp-1522233
11.661647
11.020258
2.685246
other
K1Nb2In1O6
10
225
135.5
mp-1113428
1.188414
2.411981
-5.973991
other
Cs1Rb2Dy1Cl6
10
225
411.33
mp-1111708
1.412111
2.612861
-5.867595
other
Cs1Rb2Ga1Cl6
10
225
356.17
mp-1113644
9.010362
0.485802
0.973223
other
Rb2Tl1Fe1F6
10
225
186.1
mp-1520599
5.885041
8.376747
-0.055161
other
Sr2Sm1Bi1O6
10
225
165.16
mp-1205846
11.041668
8.885052
2.569583
other
Sr2Ho1U1O6
10
225
163.26
mp-7127
7.556833
8.857774
0.373408
other
Ba2Yb1Ta1O6
10
225
157.07
mp-1110952
-1.220405
2.747488
-2.865969
other
K2Ag1Bi1I6
10
225
448.95
mp-1113703
8.368113
0.910087
1.824914
other
Rb2Li1Sc1F6
10
225
151.75
mp-1113500
1.24935
2.447619
-5.855613
other
Rb2Eu1Au1Cl6
10
225
318.08
mp-1112407
8.653837
0.616528
0.888826
other
Rb2Cr1Hg1F6
10
225
208.62
mp-1223462
10.172287
10.989953
3.282174
other
K1Ce1Ti2O6
10
225
120.53
mp-1112365
8.448261
1.590993
1.193487
other
K2Nb1Hg1F6
10
225
240.36
mp-1111586
-0.547756
1.191025
-4.293414
other
Na2Al1Ag1Br6
10
225
303.81
mp-1111984
1.265669
2.309037
-5.772506
other
K2Eu1Cu1Cl6
10
225
283.33
mp-1521888
10.058097
9.725625
4.025358
other
K1La1Zr2O6
10
225
146.93
mp-1112499
8.267971
0.587207
0.808331
other
Cs2Tl1Au1F6
10
225
206.79
mp-1111109
9.022154
1.939658
1.688356
other
K2Li1Nb1F6
10
225
147.3
mp-1111638
9.095004
0.346418
0.850236
other
K2Na1Mn1F6
10
225
150.59
mp-19400
9.813361
11.45069
0.303425
other
Sr4Ni2W2O12
20
225
257.57
mp-1111661
1.516842
2.489129
-5.256546
other
Na2Ga1Hg1Cl6
10
225
280.28
mp-1112758
-0.357531
1.063249
-4.587383
other
Cs2K1Nd1Br6
10
225
446.27
mp-1111848
-0.426685
0.987252
-4.458649
other
Cs2Li1Ce1Br6
10
225
369.37
mp-1113748
8.568626
1.319094
0.870419
other
Rb2Li1As1F6
10
225
154.91
mp-1205803
9.514037
9.712439
3.59513
original
Ba2Er1Ta1O6
10
225
153.53
mp-1110754
-0.460401
1.203836
-4.478589
other
K2Rb1Sb1Br6
10
225
442.6
mp-1110811
-0.5161
1.202132
-4.561289
other
Rb2Ag1Bi1Br6
10
225
371.95
mp-989592
-5.498804
-6.744949
3.060251
other
Sr6Sn2N1F1
10
225
290.01
mp-1521094
9.041563
9.102047
2.830098
other
Ba2Ce1Sn1O6
10
225
162.31
mp-1110863
1.191714
2.130718
-5.693411
other
K2Li1Y1Cl6
10
225
281.42
mp-1205595
10.310543
10.528442
1.81964
other
Ba2Tm1Mo1O6
10
225
150.73
mp-1111874
8.63343
1.477714
0.965082
other
K2Na1Ru1F6
10
225
155.44
mp-554302
8.855155
0.24069
0.866933
other
Cs2Na1Mn1F6
10
225
175.96
mp-1223208
10.04091
9.256702
3.418241
other
La2Mg1Zr1O6
10
225
133.79
mp-1111626
1.513704
2.633721
-5.533103
other
Rb2As1Au1Cl6
10
225
284.69
mp-1521476
6.119029
10.770062
0.356403
other
Ba2Sr1Mn1O6
10
225
159.38
mp-989511
1.570123
2.616874
-5.494663
other
Cs2As1Br1Cl6
10
225
335.64
mp-1110765
-1.227356
2.817522
-2.858046
other
Rb2Cu1Bi1I6
10
225
420.35
mp-1110723
-0.470763
1.236699
-4.584828
other
Rb2Cu1Bi1Br6
10
225
340.92
mp-1111004
8.738365
1.802676
1.481099
other
K1Na2Ta1F6
10
225
195.93
mp-1111209
1.192588
2.270164
-5.838775
other
K2Rb1Lu1Cl6
10
225
365.25
mp-1110979
8.163839
1.141811
1.177713
other
Cs2Na1Sb1F6
10
225
198.77
mp-1111845
-0.399225
1.091487
-4.540864
other
Cs2Li1Nd1Br6
10
225
367.59
mp-1111640
-0.356052
1.173926
-4.476127
other
K2Na1In1Br6
10
225
350.74
mp-1091394
8.170897
7.269404
-2.340093
other
Ba2Na1I1O6
10
225
151.7
mp-1112921
1.305623
2.521376
-5.993305
other
Cs2Tb1Au1Cl6
10
225
311.19
mp-1522773
12.396445
10.262279
2.306136
other
K1Ce1Nb2O6
10
225
133
mp-1518802
9.832608
9.632063
3.701014
other
Sr2Gd1Nb1O6
10
225
153.69
mp-1078457
9.620904
10.144586
3.538079
other
Ba2Zr1Ti1O6
10
225
142.61
mp-1114122
-0.443786
1.25984
-4.573245
other
K1Rb2In1Br6
10
225
379.72
mp-1519265
12.436026
10.72635
-0.016692
other
Na1Eu1W2O6
10
225
130.45
mp-1112632
-0.599435
1.395576
-4.583816
other
Cs2As1Au1Br6
10
225
338.85
mp-568670
1.244977
2.359109
-5.964535
other
Cs2Na1Tb1Cl6
10
225
326.94
mp-1114116
-0.566182
1.294261
-4.490675
other
Rb2Tl1As1Br6
10
225
387.99
mp-1113705
8.693002
1.423238
0.952202
other
Rb2Li1Ru1F6
10
225
148.57
mp-1522988
9.300382
11.059027
-2.043797
other
Na2Bi1W1O6
10
225
143.12
mp-1113494
1.267935
2.380563
-5.854345
other
Rb2Lu1Au1Cl6
10
225
304.34
mp-1516546
11.444956
10.166927
0.973646
other
Eu2V1Sb1O6
10
225
124.52
mp-1112942
-1.345421
2.772869
-2.520806
other
Cs2Pr1Ag1I6
10
225
474.63
mp-1111479
1.267946
2.512518
-6.106405
other
Cs2Rb1Tm1Cl6
10
225
378.97
mp-1111187
-0.440099
1.291607
-4.297036
other
Na2Ag1Au1Br6
10
225
311.06
mp-1112586
8.504809
0.79089
1.632928
other
Cs2Al1In1F6
10
225
192.49
mp-1111191
9.562394
0.497197
0.620526
other
Na1Li2Mn1F6
10
225
136.82
mp-1113140
8.313257
1.300503
1.117149
other
Cs2In1As1F6
10
225
214.76
mp-989522
-6.668082
-8.67181
2.429987
other
Mg6Bi2P1N1
10
225
204.39
mp-1112274
8.589863
1.543841
1.303147
other
K2Ti1Ag1F6
10
225
171.25
mp-1111509
1.233238
1.991047
-5.378871
other
Na2Ce1Cu1Cl6
10
225
285.3
mp-1111449
1.220163
2.348982
-5.909362
other
Cs2Sm1Cu1Cl6
10
225
289.57
mp-1520930
8.301862
11.132857
2.176384
other
Eu2Zr1Cr1O6
10
225
131.02
mp-1521466
6.288506
11.263906
0.897747
other
Ca2Dy1Mn1O6
10
225
133.86
mp-1110786
8.170263
0.82272
1.519745
other
Rb2Y1Ag1F6
10
225
187.56
mp-1111410
8.461147
1.430899
0.998971
other
Na2Ti1Hg1F6
10
225
211.4
mp-14294
7.619303
8.873264
0.055668
other
Ba2Yb1Sb1O6
10
225
156.31
mp-1112918
-0.451147
1.104162
-4.628693
other
Cs2Y1Au1Br6
10
225
369.48
mp-1113218
1.487498
2.713322
-5.837666
other
Cs2Ga1Au1Cl6
10
225
282.46
mp-1522277
5.67518
10.517216
-1.26777
other
Na2Ce1Fe1O6
10
225
133.45
mp-1211836
-0.32406
0.690115
-3.736657
other
K8Zr6Be1Br20
35
225
1,147.07
mp-1110712
-0.417229
1.007458
-4.230633
other
Rb2Li1Ce1Br6
10
225
359.66