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-560071
9.036082
0.248382
0.569796
original
K1Rb2Co1F6
10
225
162.27
mp-1516366
9.821448
9.782646
3.70617
other
Pr1Eu2Nb1O6
10
225
160.82
mp-20364
6.847044
5.575101
-3.348343
other
K3Rh1N6O12
22
225
278.57
mp-1111198
8.650743
1.739972
1.472007
other
K2Nb1Tl1F6
10
225
212.8
mp-1110784
8.871206
1.890208
1.32313
other
Rb2Ag1Mo1F6
10
225
173.53
mp-1111471
1.420232
2.721222
-6.002966
other
Cs2Cu1Bi1Cl6
10
225
300.32
mp-1111560
9.648421
0.687297
0.290694
other
Li2Cu1Ni1F6
10
225
123.68
mp-1206332
9.300283
9.077061
2.373116
other
Sr2La1Sb1O6
10
225
161.33
mp-1205683
1.486648
2.635704
-5.94014
original
Cs2K1Cr1Cl6
10
225
303.69
mp-1079583
8.711057
0.640735
1.503766
other
Rb2Na1Al1F6
10
225
150.8
mp-1113777
8.212955
0.783179
0.668627
other
Rb2Hg1Pd1F6
10
225
182.96
mp-1113230
8.067745
0.731633
1.480034
other
Cs2Pr1Ag1F6
10
225
221.85
mp-1113778
8.833825
0.48464
0.803712
other
Rb2Fe1Hg1F6
10
225
186.52
mp-1206763
10.967773
8.747416
2.566423
other
Ba2Sc1U1O6
10
225
154.92
mp-1111665
8.710127
1.071759
0.483451
other
K2Li1Rh1F6
10
225
128.57
mp-1110700
-0.450037
1.186684
-4.506401
other
Rb2Na1Sb1Br6
10
225
376.51
mp-1112004
1.415553
2.644
-5.870569
other
Cs2Rb1Tl1Cl6
10
225
379.6
mp-1205685
7.520278
8.39866
0.881609
other
Ba2Y1Zr1O6
10
225
165.73
mp-1110605
8.595476
1.686163
1.394253
other
Rb2Nb1Ag1F6
10
225
189.19
mp-1111716
-0.509265
1.240389
-4.50635
other
Rb2Sb1Au1Br6
10
225
358.33
mp-1111019
8.734228
0.856657
1.397776
other
K1Na2Al1F6
10
225
156.9
mp-1112599
8.332685
0.549293
0.664964
other
Cs2K1Au1F6
10
225
211.54
mp-567498
1.191717
2.177369
-5.777657
other
Rb2Na1Tm1Cl6
10
225
308.01
mp-1112229
1.154973
2.024842
-5.541024
other
K2Lu1Cu1Cl6
10
225
269.17
mp-1517407
5.796459
10.600383
0.031019
other
Sr2Pr1Co1O6
10
225
142.11
mp-1111334
9.189898
0.485246
0.376568
other
Na2Co1Ag1F6
10
225
150.92
mp-1113081
8.264522
0.850682
1.869822
other
Cs2Li1Sc1F6
10
225
169.87
mp-1110861
1.418241
2.649526
-5.386635
other
K2Na1Mo1Cl6
10
225
279.27
mp-1095039
8.087615
11.341879
2.011004
other
Sr4Hf2Cr2O12
20
225
256.6
mp-6428
7.748433
10.332757
1.606297
other
Ba2Y1Ru1O6
10
225
151.04
mp-1111085
9.26845
1.912084
1.308728
other
Na2V1Au1F6
10
225
165.35
mp-1205776
8.576838
10.557989
1.277571
other
Sr2In1Os1O6
10
225
137.71
mp-1112261
9.001581
0.613519
0.865026
other
K2Mn1Au1F6
10
225
167.21
mp-989388
1.971343
3.007406
-4.828563
other
Rb2S1Cl6F1
10
225
252.94
mp-1111799
-1.309903
2.676677
-2.548104
other
Rb2Sc1Ag1I6
10
225
419.18
mp-1111264
8.835127
0.430568
0.649685
other
K2Tl1Ni1F6
10
225
169.75
mp-1111022
8.553155
1.535031
1.401402
other
Na2In1Ga1F6
10
225
179.29
mp-1113232
1.442092
2.890058
-5.589398
other
Cs2Ag1Mo1Cl6
10
225
291.73
mp-1111736
-0.512936
1.181347
-4.568416
other
Rb2Al1Ag1Br6
10
225
317.57
mp-560671
9.053077
1.556448
1.421592
other
Rb2Na1V1F6
10
225
149.47
mp-1221598
9.997266
9.638511
-1.230911
other
Mn2Te2Pb4O12
20
225
274.98
mp-1206730
8.455675
11.246073
0.879304
other
Sr2Mg1Mo1O6
10
225
128.14
mp-1111743
-0.505966
1.260471
-4.288498
other
Na2Al1Hg1Br6
10
225
328.45
mp-1113549
-1.239623
2.917737
-2.96929
other
Rb2Ga1Hg1I6
10
225
423.57
mp-1114018
1.188394
2.219174
-5.790862
other
Rb2Na1La1Cl6
10
225
339
mp-989529
1.317783
2.554168
-5.837071
other
K1Rb2In1Cl6
10
225
338.44
mp-1110596
8.579039
0.705714
1.356794
other
Rb2Al1Au1F6
10
225
166.48
mp-1112144
-1.290955
2.732573
-2.446565
other
Cs2Na1Pr1I6
10
225
498.31
mp-1519771
7.610331
8.887359
0.610024
other
Sr2Tb1Ti1O6
10
225
146.11
mp-1110808
-0.74421
1.288988
-4.413249
other
Rb2Ag1Mo1Br6
10
225
328.79
mp-1518753
5.62003
10.276746
-0.258534
other
Sr2Sm1Fe1O6
10
225
139.86
mp-12912
7.812314
10.268132
1.623026
other
Ba2Pr1Ru1O6
10
225
160.76
mp-1111269
-1.187893
2.892933
-2.887423
other
K2Tl1In1I6
10
225
489.29
mp-1112340
8.297371
0.767871
0.590055
other
Cs2Tl1Rh1F6
10
225
207.6
mp-1111106
8.648934
0.822014
1.329233
original
K2Na1Ga1F6
10
225
148.42
mp-1111629
1.4385
2.562828
-5.727827
other
Rb2Tl1Ag1Cl6
10
225
302.79
mp-1110748
-1.244018
2.537735
-2.395394
other
Rb2Li1Nd1I6
10
225
451.11
mp-1520834
8.419952
8.731152
1.170902
other
K1Hf2Bi1O6
10
225
141.02
mp-1110658
8.334188
1.028434
1.65998
other
Rb2Y1Cu1F6
10
225
179.31
mp-1112759
1.386841
2.685104
-6.001964
other
Cs2K1In1Cl6
10
225
347.13
mp-1521626
9.954895
9.404927
0.831341
other
Ca2Bi1Sb1O6
10
225
152.98
mp-1110897
-0.397387
1.163106
-4.440806
other
K2Na1Bi1Br6
10
225
379.99
mp-1111300
8.534392
1.273984
0.329663
other
Na2Rh1Au1F6
10
225
166.45
mp-1112438
-1.233716
2.874014
-2.910191
other
K2Al1Au1I6
10
225
390.04
mp-1114004
1.429678
2.577085
-5.774875
other
Rb2Tl1Ga1Cl6
10
225
322.48
mp-1110634
9.046617
1.659582
1.116194
other
Na2Li1Ru1F6
10
225
126.69
mp-1110866
1.130993
2.094921
-5.678301
other
K2Li1Pr1Cl6
10
225
299.07
mp-1112430
1.149907
2.169745
-5.68737
other
Rb2Sm1Cu1Cl6
10
225
291.54
mp-1519127
7.818804
8.777283
0.329986
other
Tb1Eu2Ge1O6
10
225
135.8
mp-1112328
-0.528678
1.183
-4.588673
other
Cs1K2Al1Br6
10
225
406.43
mp-1111242
-0.428807
1.234455
-4.532828
other
K2Li1Tl1Br6
10
225
333.46
mp-1205568
7.184723
10.398426
0.438422
other
Sr2Li1Os1O6
10
225
124.74
mp-1111379
8.582828
0.797665
1.535357
other
K2Al1Tl1F6
10
225
179.37
mp-1110767
-1.220458
2.610143
-2.430895
other
Rb2Na1Y1I6
10
225
468.71
mp-1111944
8.238998
0.86896
1.068176
other
K2In1Au1F6
10
225
188.93
mp-1516435
9.456905
9.212658
2.255203
other
La1Eu2Sb1O6
10
225
156.12
mp-15626
8.660421
1.466454
1.540652
other
Rb2Na1Ti1F6
10
225
162.66
mp-556320
9.005618
0.343273
0.913695
other
Cs2Na1Fe1F6
10
225
162.62
mp-20966
10.243887
9.312333
2.305442
other
Ba2U1Co1O6
10
225
150.74
mp-6037
9.1276
9.092394
2.347523
other
Ba2Sm1Sb1O6
10
225
160.31
mp-1110752
-0.361605
1.066653
-4.372494
other
K2Rb1Y1Br6
10
225
439.89
mp-1111358
9.244989
1.488823
1.164029
other
Li2Ga1Cu1F6
10
225
133.4
mp-1113048
8.763129
0.645387
1.245966
other
Cs2Rb1Al1F6
10
225
151.24
mp-1113550
-0.496879
1.217438
-4.572772
other
Rb2In1Hg1Br6
10
225
367.21
mp-1112199
8.172932
0.945153
1.133488
other
K2In1Hg1F6
10
225
197.63
mp-1112270
8.175053
1.020794
1.039636
other
Cs1K2Sb1F6
10
225
249.13
mp-1205702
10.552577
11.014205
0.001026
other
Co1Re1Pb2O6
10
225
130.13
mp-1111589
-0.527079
1.250552
-4.382668
other
K2Tl1As1Br6
10
225
383.01
mp-1520511
9.533434
9.604299
3.362526
other
Sr2Hf1Sn1O6
10
225
140.22
mp-6192
9.080138
9.124493
2.300069
other
Ba2Dy1Sb1O6
10
225
154.81
mp-1205837
10.228549
10.519437
1.853329
other
Ba2Ho1Mo1O6
10
225
152.89
mp-1111724
1.20136
2.303156
-5.764201
other
Rb2Tb1Ag1Cl6
10
225
314.79
mp-1111937
8.235384
0.781257
0.682286
other
K2Hg1Au1F6
10
225
188.48
mp-1205485
11.89139
10.22247
0.832344
other
Sc2Cr1Re1O6
10
225
115.82
mp-1205885
10.610928
8.708513
2.657041
other
Ba2Nd1Pu1O6
10
225
177.75
mp-1518357
11.69366
9.902946
2.847114
other
Eu2Hf1Nb1O6
10
225
135.83
mp-989639
8.145764
0.627759
1.219048
other
Cs2K1In1F6
10
225
211.16
mp-21370
8.89601
9.223035
1.84212
other
Ba2Eu1Sb1O6
10
225
160.19
mp-1113362
-1.346156
2.728427
-2.446816
other
Cs2Ce1Cu1I6
10
225
439.65
mp-12730
7.072163
10.16943
0.766274
other
Ba2Yb1Ru1O6
10
225
148.59