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-1110611
9.076818
0.258389
0.542374
other
Rb2Co1Ag1F6
10
225
159.22
mp-1112924
-0.524672
1.290385
-4.712089
other
Cs2In1Au1Br6
10
225
350.95
mp-1094048
6.143664
10.450081
0.244224
other
Sr2Ti1Fe1O6
10
225
122.45
mp-1205806
11.194815
11.086768
-0.118307
other
Fe1Pb2W1O6
10
225
128.96
mp-13941
9.341131
10.788815
1.200408
other
Sr2Yb1Re1O6
10
225
142.45
mp-1207138
9.916967
9.78702
3.647191
other
Sm1Eu2Ta1O6
10
225
153.96
mp-1111373
8.90515
0.522707
0.915108
other
K2Tl1Fe1F6
10
225
192.68
mp-1113017
1.409899
2.633426
-5.93356
other
Cs2Li1In1Cl6
10
225
288.87
mp-1112516
1.244574
2.519487
-6.078311
other
Cs2Rb1Gd1Cl6
10
225
392.82
mp-1520435
5.707284
10.051143
-0.350992
other
Ba2Sm1Fe1O6
10
225
149.12
mp-1112872
1.280313
2.384731
-5.982211
other
Cs2K1Ce1Cl6
10
225
386.63
mp-1112123
1.262184
2.487444
-6.055039
other
Cs2Rb1Nd1Cl6
10
225
392.7
mp-644092
3.492807
-0.656768
-2.441497
other
Na2Li1Al1H6
10
225
95.74
mp-1206057
9.948667
10.380105
3.507981
other
Sr2Nb1Al1O6
10
225
122.23
mp-1111627
8.505544
0.748347
0.533288
other
K2Na1Pd1F6
10
225
159.34
mp-1079458
1.275053
2.311959
-5.92616
other
Cs2Na1Ce1Cl6
10
225
343.03
mp-1112221
8.492901
1.405056
1.452894
other
K2In1Ga1F6
10
225
178.27
mp-1114046
-0.488494
1.204559
-4.588898
other
K1Rb2Al1Br6
10
225
363.96
mp-1113201
1.39603
2.677555
-5.917333
other
Cs2In1Ga1Cl6
10
225
327.02
mp-1110938
-1.194594
2.379236
-2.309548
other
K2Li1Pr1I6
10
225
448.24
mp-1206059
1.45001
2.491748
-5.768641
other
Rb2Na1Cr1Cl6
10
225
272.94
mp-1114229
9.714794
1.968591
1.644088
other
Na2Li1V1F6
10
225
121.88
mp-1112034
-0.329423
1.091161
-4.283334
other
K2Y1Cu1Br6
10
225
327.14
mp-1110589
8.36652
1.197017
0.639846
other
Rb2Ir1Au1F6
10
225
181.23
mp-1518318
6.596952
10.084033
0.589559
other
Eu2Hf1Fe1O6
10
225
130.59
mp-1111477
1.462181
2.414747
-5.489023
other
Na2Li1In1Cl6
10
225
257.05
mp-1113047
-0.397207
1.051076
-4.63679
other
Cs2K1Sc1Br6
10
225
397.48
mp-1521761
5.900641
11.005376
0.156701
other
Sr2Ca1Mn1O6
10
225
133.66
mp-1112473
1.192225
2.211427
-5.713543
other
K2Er1Ag1Cl6
10
225
304.36
mp-1206631
10.411417
11.284644
-0.776145
other
Ni2Pb4W2O12
20
225
262.65
mp-1110599
8.534408
1.428368
1.337854
other
Rb2Ti1Ag1F6
10
225
176.35
mp-1112515
1.278357
2.507206
-6.083896
other
Cs2Rb1Lu1Cl6
10
225
376.92
mp-1112483
8.595699
1.614291
1.60078
other
Cs2Ta1Tl1F6
10
225
212.02
mp-989540
-5.529134
-6.923098
3.251957
other
Sr6Sn2N1O1
10
225
284.14
mp-1111585
-0.473038
1.270445
-4.486537
other
K2Tl1Au1Br6
10
225
352.39
mp-1114131
-0.522882
1.19901
-4.503972
other
Rb2In1Sb1Br6
10
225
407.42
mp-1205311
9.403293
9.730215
-0.365154
other
Sr8Ni4Te4O24
40
225
513.15
mp-1110788
8.099401
0.75454
1.448128
other
Rb2Pr1Ag1F6
10
225
215.18
mp-13935
9.303699
10.694169
1.411507
other
Ba2Yb1Re1O6
10
225
149.67
mp-1110862
1.34126
2.402209
-5.750763
other
K2Na1In1Cl6
10
225
292.39
mp-1111935
8.846196
0.647152
0.794292
other
K2Fe1Hg1F6
10
225
179.98
mp-1110590
8.210641
0.78641
1.076368
other
Rb2In1Au1F6
10
225
193.14
mp-1111996
1.191865
2.209713
-5.712581
other
K2Ce1Au1Cl6
10
225
326.93
mp-1113205
1.448241
2.625968
-5.919906
other
Cs2Tl1Cu1Cl6
10
225
288.92
mp-19159
11.055142
10.936657
-0.33063
other
Ca2Pd1W1O6
10
225
134.68
mp-1206223
11.033251
8.857825
2.604513
other
Sr2Lu1U1O6
10
225
159.46
mp-1111415
8.622354
1.732856
1.462513
other
K2Ta1Tl1F6
10
225
220.03
mp-1112149
-1.277002
3.09666
-2.89347
other
Cs2Na1In1I6
10
225
463.14
mp-1112360
8.365977
1.322831
1.143852
other
K2Ti1Hg1F6
10
225
222.14
mp-9839
8.863998
0.74047
1.481791
other
K2Li1Al1F6
10
225
126.98
mp-1112681
1.253514
2.388342
-6.00179
other
Cs2Li1La1Cl6
10
225
319.74
mp-989531
8.464338
0.643812
1.33535
other
Cs2K1Ga1F6
10
225
191.97
mp-989644
1.339176
2.519739
-5.951972
other
Cs2Na1Ca1Cl6
10
225
329.02
mp-1114112
-0.35463
1.058784
-4.425018
other
Rb2Y1Tl1Br6
10
225
430.55
mp-1111272
8.682492
1.672698
1.0986
other
Na2Cu1Sb1F6
10
225
164.89
mp-1110982
8.208121
0.955585
1.896705
other
Cs2Na1Ce1F6
10
225
206.49
mp-1111719
1.35169
2.649326
-5.857346
other
Rb2Bi1Au1Cl6
10
225
320.75
mp-504603
8.837708
0.403407
0.944441
other
Cs2Tl1Fe1F6
10
225
206.66
mp-1114009
1.539776
2.609126
-5.687689
other
Rb2Tl1As1Cl6
10
225
338.31
mp-1112052
8.430392
1.268351
1.397384
other
Cs1K2Ti1F6
10
225
216.17
mp-1111709
1.512252
2.613424
-5.764864
other
Cs1Rb2As1Cl6
10
225
380.12
mp-1111360
9.049774
1.890611
1.06229
other
Li2Cu1As1F6
10
225
147.53
mp-1113709
9.079439
0.368282
0.203772
other
Rb2Li1Ni1F6
10
225
141.28
mp-1523060
7.50008
8.365423
0.754724
other
Sr2Tb1Hf1O6
10
225
157
mp-1114043
1.519253
2.580302
-5.714281
other
K1Rb2As1Cl6
10
225
331.54
mp-1114016
-0.379022
1.013168
-4.381593
other
Rb2Na1Sc1Br6
10
225
347.14
mp-1206179
10.842018
9.457044
2.859123
other
Ba2Pu1Ti1O6
10
225
149.8
mp-1112013
8.520423
1.163898
0.883215
other
Cs2Na1Ru1F6
10
225
176.56
mp-1111040
-1.223852
2.763652
-2.977182
other
Rb2Hg1Bi1I6
10
225
482.99
mp-1113055
-1.230256
2.945861
-2.946547
other
Cs2K1Bi1I6
10
225
541.59
mp-1227065
9.970592
9.216152
3.504537
other
Ca1La2Zr1O6
10
225
151.27
mp-1112240
8.083235
0.681946
1.421473
other
Cs1K2Y1F6
10
225
247.12
mp-1112108
-0.451831
1.210975
-4.709061
other
Cs2Tl1Sb1Br6
10
225
428.71
mp-1111470
1.230697
2.370533
-5.934724
other
Cs2Pr1Cu1Cl6
10
225
306.89
mp-1111380
8.972385
1.498249
1.463494
other
K2Rb1V1F6
10
225
192.81
mp-1111108
8.552848
1.365771
0.96114
other
K2Na1As1F6
10
225
163.06
mp-1110745
-1.304389
2.415222
-2.496817
other
Rb2Li1Ta1I6
10
225
398.58
mp-573204
8.00393
0.848579
1.339547
other
Cs2K1Bi1F6
10
225
233
mp-1520823
9.936219
9.706908
3.737569
other
Sr2Y1Nb1O6
10
225
150.56
mp-1112271
9.0624
1.630961
1.281902
other
K2V1Ag1F6
10
225
166.45
mp-1110584
8.346587
1.013019
0.451972
other
Rb2Rh1Au1F6
10
225
176.63
mp-1206737
8.65414
10.983085
0.654693
other
Na1Sr2Re1O6
10
225
138.62
mp-1113711
9.158207
0.360207
0.767926
other
Rb2Li1Mn1F6
10
225
145.09
mp-1112071
-1.178913
2.929045
-2.961303
other
K2Ga1Au1I6
10
225
395.1
mp-22184
9.572287
9.6277
3.530253
other
Ba2Sm1Nb1O6
10
225
162.34
mp-1113739
1.291852
2.079047
-5.467601
other
Na2Li1Nd1Cl6
10
225
286.6
mp-21150
7.138406
5.531519
-2.897543
other
Sr2Ni1N6O12
21
225
257.48
mp-1112760
1.274496
2.441236
-6.035649
original
Cs2K1Lu1Cl6
10
225
354.78
mp-1519302
11.990737
10.159069
0.444908
other
Ca2Sb1W1O6
10
225
147.53
mp-1110907
-0.309891
1.063364
-4.236246
other
K2Pr1Cu1Br6
10
225
346.42
mp-1110872
1.19244
2.244437
-5.742121
other
K2Y1Ag1Cl6
10
225
308.29
mp-23120
1.287536
2.395949
-6.003675
other
Cs2Na1Y1Cl6
10
225
324.97
mp-1110847
8.172437
0.808279
1.473108
other
K2Y1Ag1F6
10
225
196.29
mp-1518752
12.356893
10.299705
2.259083
other
K1Nd1Nb2O6
10
225
134.75
mp-1110824
-1.288365
2.650483
-2.485232
other
Rb2Nd1Ag1I6
10
225
464.15
mp-559695
8.036094
0.802515
1.268003
other
Cs2Rb1Bi1F6
10
225
248.1
mp-557533
8.767397
1.232101
1.406309
other
Cs2Tl1V1F6
10
225
208.42
mp-1112179
8.38535
1.24056
1.850588
other
K2Sc1In1F6
10
225
198.09
mp-1111990
1.152007
2.180183
-5.666516
other
K2Sc1Hg1Cl6
10
225
313.97
mp-1110935
-0.340279
0.913312
-4.130469
other
K2Na1Ce1Br6
10
225
386.72