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-1111590
1.378953
2.501291
-5.713898
other
K2Al1Tl1Cl6
10
225
310.84
mp-1111113
8.971525
1.615096
0.762968
other
Li2Cu1Ir1F6
10
225
140.18
mp-1111926
8.644923
1.360544
0.863956
other
K2Li1Ir1F6
10
225
139.61
mp-1113150
8.280803
0.537858
0.685673
other
Cs2Tl1Ag1F6
10
225
204.34
mp-1112289
8.39157
0.584778
0.565893
other
K2Ag1Au1F6
10
225
176.04
mp-1111621
1.18126
2.062065
-5.652837
other
K2Na1Sc1Cl6
10
225
284.98
mp-643397
8.587688
1.488606
-4.286888
other
H8Pd1N2Cl6
17
225
232.73
mp-1111508
1.250035
2.048521
-5.430123
other
Na2Er1Cu1Cl6
10
225
266.17
mp-504699
10.578929
9.37974
2.238955
other
Ba2U1Fe1O6
10
225
150.94
mp-1111646
1.236672
2.262068
-5.777244
other
K2Na1Eu1Cl6
10
225
318.72
mp-1113893
8.302489
0.572479
0.700701
other
K1Rb2Au1F6
10
225
204.04
mp-989400
8.605851
0.689434
1.301484
other
Rb2Na1Ga1F6
10
225
157.3
mp-1111532
1.234649
2.037494
-5.371078
other
Na2Sc1Cu1Cl6
10
225
247.68
mp-1522778
8.299787
11.554766
1.335855
other
Sr2Nd1V1O6
10
225
147.35
mp-1521253
7.860107
11.018362
1.426946
other
Eu2Cr1Sn1O6
10
225
128.04
mp-1110970
8.745306
1.655477
1.584554
other
Cs2Li1Ta1F6
10
225
171.28
mp-1111005
8.323148
1.035829
1.594861
other
K1Na2Sc1F6
10
225
181.86
mp-1111994
1.117023
2.036792
-5.583761
other
K2Dy1Cu1Cl6
10
225
276.97
mp-1112011
8.816947
1.490314
1.205148
other
K2V1Hg1F6
10
225
214.07
mp-1518369
9.952023
9.753329
3.929945
other
Na1La1Hf2O6
10
225
138.54
mp-1111606
-1.155623
2.903292
-2.913972
other
K2Rb1As1I6
10
225
504.91
mp-1520596
9.623008
9.155899
3.805255
other
Sr2Ce1Hf1O6
10
225
157.49
mp-1112133
-1.282343
3.129323
-2.938064
other
Cs2Rb1Al1I6
10
225
495.04
mp-1206567
10.363194
8.854494
3.147258
other
Ba2Sc1Pa1O6
10
225
160.85
mp-1110901
-0.329581
1.079992
-4.228373
other
K2Li1Nd1Br6
10
225
351.12
mp-1520588
11.935847
10.393959
1.419746
other
Eu2Zr1W1O6
10
225
141.83
mp-1112209
8.534478
0.908934
1.41094
other
K2Al1Hg1F6
10
225
169.74
mp-1520436
5.876485
8.387785
-0.152347
other
Ba2Tb1Bi1O6
10
225
166.89
mp-1112482
8.053248
0.89194
1.732362
other
Cs2Y1Tl1F6
10
225
222.92
mp-1228332
9.190784
9.252519
0.994131
other
Ba2Tl1Sb1O6
10
225
155.43
mp-1113409
1.307229
2.530562
-6.031661
other
Cs2Nd1Au1Cl6
10
225
336.11
mp-1112026
-0.450531
1.228407
-4.498537
other
K2Tl1Hg1Br6
10
225
374.61
mp-1111110
8.45228
0.937614
1.825583
other
K2Li1Sc1F6
10
225
142.41
mp-1245352
-0.35848
1.10052
-4.566164
other
Cs2Li1La1Br6
10
225
375.49
mp-1519577
10.562358
10.894849
0.9587
other
Sr2Eu1W1O6
10
225
159.72
mp-20720
7.119197
5.756691
-2.921858
other
Ni1Pb2N6O12
21
225
251.32
mp-1112493
-0.350796
1.028939
-4.660191
other
Cs2Sc1Tl1Br6
10
225
406.11
mp-1517095
9.859848
9.740826
3.601954
other
La1Eu2Nb1O6
10
225
163.09
mp-1205547
9.417378
9.669929
3.488552
other
Ba2Gd1Ta1O6
10
225
158.86
mp-1112690
1.283018
2.488403
-6.063824
other
Cs2K1Y1Cl6
10
225
366.01
mp-1218740
7.498261
11.012713
1.506522
other
Sr4Nb2Co2O12
20
225
257.17
mp-1079630
9.659044
10.044415
3.228051
other
Ba2Ta1In1O6
10
225
148.17
mp-1111972
1.435289
2.552024
-5.745162
other
K2Cu1Au1Cl6
10
225
248.33
mp-1110964
-1.20879
2.378272
-2.282044
other
K2Na1Ce1I6
10
225
484.56
mp-504723
9.854092
11.286983
0.511239
other
Ba4Ni2W2O12
20
225
276.36
mp-1111734
-0.534706
1.287737
-4.543514
other
Rb2Ag1Au1Br6
10
225
310.59
mp-1205694
8.710483
11.229084
0.281221
other
Li1Ca2Re1O6
10
225
118.39
mp-1112601
8.955523
0.591524
0.900518
other
Cs2Co1Hg1F6
10
225
144.72
mp-1111588
1.529509
2.547764
-5.632831
other
K2Tl1As1Cl6
10
225
333.39
mp-1111105
9.260061
0.369722
0.398977
other
K2Na1Co1F6
10
225
142.07
mp-1112020
-1.167497
2.887973
-2.92795
other
K2In1As1I6
10
225
445.36
mp-989559
8.293806
1.143971
-0.095039
other
Cs2Na1Li1F6
10
225
172.29
mp-1523148
9.121811
9.121634
2.306579
other
Ba2La1Sb1O6
10
225
166.65
mp-1516804
10.081423
9.949011
3.376554
other
Eu2Nb1In1O6
10
225
140.35
mp-1110851
8.131902
0.935092
1.212384
other
K2Ag1Bi1F6
10
225
205.2
mp-1189427
5.80867
3.438502
-3.564401
other
Zr1C8N2Cl6
17
225
342.74
mp-1110744
-1.222262
2.555537
-2.420274
other
Rb2Li1Y1I6
10
225
434.14
mp-1520585
11.932671
10.850919
0.613504
other
Eu2V1W1O6
10
225
129.93
mp-1521512
6.34611
11.058167
1.016071
other
Sr2Nd1Mn1O6
10
225
147.68
mp-1519364
7.458113
8.535704
0.964413
other
Ba2Ce1Bi1O6
10
225
176.47
mp-1113854
8.375375
1.162934
0.899581
other
Rb2Tl1Ru1F6
10
225
202.51
mp-1113393
-0.524348
1.290118
-4.654363
other
Cs2Sb1Au1Br6
10
225
365.71
mp-1522271
11.067735
10.332017
1.308407
other
Ba2La1W1O6
10
225
167.19
mp-1078205
8.170307
0.753524
1.167535
other
K1Rb2In1F6
10
225
200.88
mp-1520691
10.070486
9.677072
4.034077
other
Eu2Hf1Zr1O6
10
225
144.14
mp-1112158
1.142123
2.08447
-5.599074
other
K2Y1Cu1Cl6
10
225
277.24
mp-1111189
9.144019
0.757485
0.63421
other
Na2Co1Hg1F6
10
225
155.04
mp-1110677
1.236739
2.191925
-5.19004
other
Rb2Na1Ta1Cl6
10
225
287.68
mp-1111231
-1.207811
2.828277
-2.746077
other
K2Na1In1I6
10
225
446.96
mp-571467
-0.358723
1.080855
-4.556389
other
Cs2Na1Y1Br6
10
225
381.4
mp-1517357
6.538834
11.137887
1.165859
other
Sr2Ce1Ni1O6
10
225
133.75
mp-1112871
-0.72098
1.283235
-4.625401
other
Cs2K1Mo1Br6
10
225
387.69
mp-1110673
8.068991
0.723507
1.505231
other
K2Rb1Nd1F6
10
225
241.09
mp-1112892
-0.521507
1.220466
-4.723526
other
Cs2In1Bi1Br6
10
225
426.69
mp-1110900
-0.317316
1.0721
-4.242311
other
K2Li1Pr1Br6
10
225
354.9
mp-1113931
8.148513
0.942422
1.765624
other
Rb2Y1In1F6
10
225
223.8
mp-6645
-4.625892
-7.043979
2.824651
other
Ba14Na14Ca1N6
35
225
1,439.66
mp-1110672
8.058543
0.699658
1.389799
other
K2Rb1Pr1F6
10
225
243.55
mp-559454
8.86514
0.332067
0.973454
other
Cs2K1Fe1F6
10
225
195.18
mp-1519158
11.581054
10.647711
0.175372
other
Mg1Sn2W1O6
10
225
129.48
mp-18904
10.440282
10.482342
1.666607
other
Ba2Nd1Mo1O6
10
225
162.44
mp-1111064
-0.499094
1.252133
-4.284307
other
Na2Ga1Hg1Br6
10
225
329.23
mp-1113787
9.284904
1.794713
1.503625
other
Rb2V1Cu1F6
10
225
152.93
mp-1111981
1.392853
2.487846
-5.606276
other
K2Ga1Hg1Cl6
10
225
286.94
mp-1110932
-0.295202
1.010524
-4.230309
other
K2Na1Pr1Br6
10
225
387.55
mp-1112908
-1.218229
2.879455
-3.094188
other
Cs2Hg1As1I6
10
225
441.25
mp-19085
10.674976
11.140951
0.657955
other
Ba4Mn2W2O12
20
225
290.59
mp-1112330
8.112009
0.961504
1.210373
other
K2Bi1Au1F6
10
225
211.41
mp-567628
-0.384824
1.110141
-4.35331
other
Rb2Li1Dy1Br6
10
225
340.28
mp-1205651
11.001725
8.893801
2.545729
other
Sr2Nd1U1O6
10
225
175.31
mp-1517471
6.778321
10.268825
0.409041
other
Eu2Cr1In1O6
10
225
129.04
mp-989520
1.351768
2.569839
-5.836766
other
Rb2Na1Bi1Cl6
10
225
328.42
mp-989405
-0.522888
1.280718
-4.758027
other
Cs2Li1In1Br6
10
225
341.24
mp-18903
10.07402
11.245152
0.814916
other
Sr2Cd1W1O6
10
225
145.8
mp-1112290
8.437993
1.3337
0.780528
other
K2Ag1As1F6
10
225
179.39
mp-1079926
9.526478
10.220223
2.713029
other
La2Zr1Ni1O6
10
225
133.11
mp-1112607
8.049383
0.817858
1.56371
other
Cs2Y1Hg1F6
10
225
225.09
mp-989587
1.815341
2.950073
-4.882271
other
K2S1Br1Cl6
10
225
296.65
mp-1189040
5.707009
3.496043
-3.610768
other
Pt1C8N2Cl6
17
225
319.48
mp-1114086
-0.474833
1.238396
-4.591768
other
Rb2Tl1Hg1Br6
10
225
377.45