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-1111467
1.381467
2.598235
-5.698447
other
Rb2Al1Au1Cl6
10
225
268.1
mp-550685
9.373142
9.18983
0.355124
other
Ba2Ca1Te1O6
10
225
154
mp-1114072
-0.436542
1.195532
-4.529919
other
Rb2In1Ga1Br6
10
225
367.16
mp-1112066
1.253215
2.292583
-5.766981
other
K2Lu1Au1Cl6
10
225
300.89
mp-1516850
5.858466
8.458942
-0.072506
other
Sr2Gd1Bi1O6
10
225
162.5
mp-1111833
-0.406732
1.135357
-4.554303
other
Cs2Li1Y1Br6
10
225
339.62
mp-1113655
1.222128
2.371952
-5.876653
other
Rb2Dy1Au1Cl6
10
225
313.81
mp-1518803
10.592978
9.696123
2.714883
other
Sr2Nb1Bi1O6
10
225
159.25
mp-989504
8.632179
1.77849
-0.87835
other
Na2Li1N1F6
10
225
109.26
mp-1112359
8.11566
1.045397
1.49474
other
K2In1Bi1F6
10
225
226.82
mp-1114071
1.287623
2.597216
-5.783519
other
Rb2In1Bi1Cl6
10
225
371.35
mp-1111931
8.206593
0.988804
1.578769
other
K2Sc1Hg1F6
10
225
192.84
mp-1522479
5.858367
8.457549
-0.084484
other
Sr2Y1Bi1O6
10
225
159.67
mp-1218831
7.083404
11.128159
0.818265
other
Sr2Fe1Ru1O6
10
225
125.26
mp-1113545
-1.193137
2.863719
-3.050281
other
Rb2Hg1As1I6
10
225
433.19
mp-1110896
1.357457
2.494921
-5.77517
other
K2Na1Bi1Cl6
10
225
323.54
mp-1113791
8.580876
0.464523
0.808911
other
Rb2Tl1Cu1F6
10
225
172.13
mp-1110719
-0.47229
1.215178
-4.55402
other
Rb2Cu1Sb1Br6
10
225
330.48
mp-1112098
1.144729
2.197606
-5.723522
other
K2Dy1Ag1Cl6
10
225
308.23
mp-1110651
8.326305
1.368526
1.024138
other
Rb2Li1Sb1F6
10
225
167.87
mp-1111963
8.127721
0.787557
1.83127
other
Cs2Rb1Sc1F6
10
225
215.64
mp-1111316
8.369134
1.075149
1.390272
other
Na2Sc1Ag1F6
10
225
170.33
mp-545603
9.423312
9.263223
1.106196
other
Ba2Bi1Sb1O6
10
225
163.08
mp-1080738
12.307856
10.819725
0.002972
other
Sn2Mo1Os1O6
10
225
133.54
mp-1112131
-1.203664
2.994282
-3.054119
other
Cs2Rb1As1I6
10
225
516.63
mp-1205691
7.690211
10.675643
1.191688
other
Ba2Zn1Os1O6
10
225
134.13
mp-1111453
8.099311
0.742046
1.71367
other
Cs1Rb2Sc1F6
10
225
227.18
mp-1110894
-0.686764
1.263311
-4.358849
other
K2Na1Mo1Br6
10
225
331.6
mp-1111971
8.226825
0.721026
0.808794
other
Cs1K2Tl1F6
10
225
244.23
mp-1110941
-1.199497
2.643955
-2.755881
other
K2Li1Bi1I6
10
225
439.48
mp-1111785
-0.550828
1.195898
-4.666149
other
Cs1Rb2Al1Br6
10
225
410.9
mp-1110816
-1.265572
2.683391
-2.522308
other
Rb2Y1Ag1I6
10
225
446.9
mp-1112440
1.385181
2.549612
-5.620404
other
K2Al1Au1Cl6
10
225
262.93
mp-1207104
1.248327
2.403249
-6.006983
other
Cs2K1Ho1Cl6
10
225
361.76
mp-1522771
8.50556
11.328414
1.162918
other
Ba2V1Bi1O6
10
225
152.99
mp-19258
10.430875
10.496781
1.677686
other
Ba2Sm1Mo1O6
10
225
159.42
mp-989544
8.50063
1.455049
0.272459
other
Cs2Se1Cl1F6
10
225
233.27
mp-1112048
-1.255512
2.49809
-2.384648
other
K2Ce1Cu1I6
10
225
427.57
mp-1112570
8.529057
0.614666
1.334515
original
Cs2Na1Ga1F6
10
225
172.45
mp-1113669
8.289711
0.868894
1.857218
other
Rb2Na1Sc1F6
10
225
167.43
mp-1114172
-1.17028
3.002049
-2.964065
other
K1Rb2Tl1I6
10
225
518.85
mp-1521309
8.226141
11.633015
1.363968
other
Sr2Sm1V1O6
10
225
144.1
mp-18992
9.730395
9.588725
0.156002
other
Ba8Mn4Te4O24
40
225
579.95
mp-1110893
1.132393
2.078358
-5.693445
other
K2Na1Nd1Cl6
10
225
325.62
mp-1113656
1.271449
2.382931
-5.860495
other
Rb2Er1Au1Cl6
10
225
310.16
mp-1112204
-0.52876
1.202246
-4.439669
other
K2Ga1Hg1Br6
10
225
336.63
mp-1205760
9.769829
9.693927
3.768379
other
Sr2Lu1Nb1O6
10
225
144.57
mp-1523086
10.220805
11.337278
0.72662
other
Eu2Zn1W1O6
10
225
124.78
mp-1111801
-1.257435
3.00584
-2.91177
other
Rb2In1Ag1I6
10
225
427.95
mp-19282
9.846869
11.429613
0.800305
other
Sr2Zn1W1O6
10
225
131.44
mp-1111404
8.463008
1.480793
0.916237
other
Na2Tl1As1F6
10
225
200.36
mp-1113614
8.546064
0.50214
1.384831
other
Cs2Al1Ag1F6
10
225
173.89
mp-1206036
10.262568
8.78247
3.172011
other
Ba2Tm1Pa1O6
10
225
170.8
mp-1516973
5.581634
10.205563
-0.650387
other
Ba2Sr1Fe1O6
10
225
156.25
mp-1111412
8.33712
1.416144
0.962611
other
Na2Sb1Au1F6
10
225
197.13
mp-1113577
-0.532961
1.211065
-4.74229
other
Cs2Al1Ag1Br6
10
225
327.09
mp-1206535
8.665962
0.332103
0.796272
other
Cs2Rb1Cu1F6
10
225
199.04
mp-1111125
8.226953
1.205377
1.112611
other
K2Tl1Sb1F6
10
225
225.96
mp-1113474
9.026715
0.314301
0.583355
other
Rb2Cu1Ni1F6
10
225
141.02
mp-6145
7.576675
10.375756
1.463446
original
Ba2Lu1Ru1O6
10
225
145.85
mp-1522162
12.389291
10.342626
2.24384
other
Na1Pr1Nb2O6
10
225
132.86
mp-1517190
9.513235
9.29376
2.354407
other
Eu2Y1Sb1O6
10
225
147.52
mp-1112110
-1.262047
3.13354
-3.015038
other
Cs2Tl1Ga1I6
10
225
469.33
mp-1111678
1.514238
2.596626
-5.675845
other
K2Li1Au1Cl6
10
225
259.05
mp-1110760
-0.459793
1.184886
-4.49978
other
K2Rb1Bi1Br6
10
225
455.29
mp-1114015
1.186902
2.18588
-5.739718
other
Rb2Na1Tb1Cl6
10
225
316.69
mp-1112164
1.156474
2.024768
-5.547871
original
K2Er1Cu1Cl6
10
225
273.53
mp-1111744
-0.311302
1.094213
-4.219672
other
Na2Y1Cu1Br6
10
225
319.76
mp-1112898
1.264385
2.448576
-5.975966
other
Cs2Y1Hg1Cl6
10
225
354.25
mp-1110967
-1.243389
2.464316
-2.40609
other
K2Ce1Ag1I6
10
225
462.79
mp-545659
5.949828
8.383429
-0.104937
other
Ba2Dy1Bi1O6
10
225
165.44
mp-1112105
-1.2827
3.013322
-3.008369
other
Cs2Tl1Sb1I6
10
225
514.61
mp-1111132
1.235847
2.068161
-5.442057
other
Na2Dy1Cu1Cl6
10
225
269.6
mp-1112939
1.27491
2.484545
-5.992775
other
Cs2Sm1Ag1Cl6
10
225
329.87
mp-1205705
11.334789
9.568236
2.253147
other
Sr2U1Cr1O6
10
225
141.41
mp-1110679
1.202376
2.248434
-5.774138
other
Rb2Li1Y1Cl6
10
225
287.78
mp-1110722
-1.332563
2.97306
-2.800775
other
Rb2Cu1Mo1I6
10
225
375.54
mp-545792
9.297863
10.765564
1.222599
other
Ba8Co4Re4O24
40
225
550.12
mp-1110688
1.166092
2.1868
-5.713891
other
Rb2Nd1Cu1Cl6
10
225
296.65
mp-1522310
9.990884
9.737105
3.986632
other
K1Nd1Hf2O6
10
225
140.07
mp-1113790
8.837223
1.872265
1.62332
other
Rb2Ta1Cu1F6
10
225
169.49
mp-989565
8.389016
0.777817
1.286981
other
Rb2Tl1Ga1F6
10
225
194.08
mp-1111960
8.194997
1.31398
0.918202
other
K2Sb1Au1F6
10
225
202.02
mp-1110809
1.231438
2.242165
-5.687829
other
Rb2Ce1Ag1Cl6
10
225
330.46
mp-1114193
-1.250987
2.618445
-2.583264
other
Rb2Y1Hg1I6
10
225
485.96
mp-1112268
8.512738
1.58379
1.45751
other
Cs1K2Ta1F6
10
225
236.9
mp-1206097
8.613069
11.092304
0.832781
other
Ba2Zn1Mo1O6
10
225
139.91
mp-6586
8.757891
0.703581
1.549771
other
K2Na1Al1F6
10
225
140.56
mp-1112058
-0.34676
1.056322
-4.353566
other
K2Y1Au1Br6
10
225
358.83
mp-1110682
1.194644
2.23664
-5.791381
other
Rb2Li1Nd1Cl6
10
225
302.12
mp-6178
8.495157
1.255603
1.4993
original
Cs2K1Ti1F6
10
225
197.97
mp-818598
7.94691
2.306211
-1.140573
other
Ta2Ni1N6F12
21
225
545.64
mp-13934
10.44003
10.280116
1.555684
other
Ba2Tm1Re1O6
10
225
148.8
mp-31756
10.405972
10.825507
1.027042
other
Ba2Fe1Re1O6
10
225
135.8
mp-1111639
1.163831
2.056757
-5.659789
other
K2Na1Lu1Cl6
10
225
299.03
mp-1113404
-0.434341
1.225273
-4.605229
original
Rb2In1Cu1Br6
10
225
317.72
mp-1111083
8.785251
1.203089
1.184662
other
Na2In1Cu1F6
10
225
153.51
mp-1111256
1.167381
2.077433
-5.661714
other
K2Li1Er1Cl6
10
225
276.47
mp-1516644
9.78638
9.659991
3.771971
other
Sr2Tb1Nb1O6
10
225
151.67
mp-1112941
-1.323306
2.993015
-2.988421
other
Cs2Ag1Sb1I6
10
225
447.11