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-17389
-4.282242
-3.969997
-3.782403
other
Pr6Si2Ag2Se14
24
173
619.56
mp-18126
-4.415471
-3.925324
-3.752396
other
Tb6Cu2Sn2Se14
24
173
595.29
mp-1200784
7.98279
5.041064
-3.909926
other
Sn2H12Cl4O22
40
173
456.49
mp-867323
-2.684232
-2.686035
-5.838841
other
Pr6Mn2Al2S14
24
173
538.94
mp-1221016
10.652689
11.566979
-2.966299
other
Na2V6Pb8O24
40
173
679.53
mp-758010
14.438817
7.282312
-7.005227
other
Li18Mn18P18O72
126
173
1,616.47
mp-1191639
-2.927318
-2.503224
-5.848882
other
Y6Al2Co2S14
24
173
488.7
mp-1191762
-2.724674
-2.675929
-5.758837
other
Pr6Ga2Fe2S14
24
173
533.03
mp-866692
-2.675771
-2.611413
-5.757673
other
La6Mn2Al2S14
24
173
548.62
mp-6253
8.842714
0.766689
1.451145
other
K2Li2Be2F8
14
173
186.66
mp-561177
10.352953
10.207916
1.019374
other
Gd6B2W2O18
28
173
356.48
mp-1192755
-4.372931
-3.971583
-3.746119
other
Nd6Ga2Fe2Se14
24
173
607.39
mp-1191911
-2.791269
-2.571811
-5.695237
other
Dy6Al2Fe2S14
24
173
476.78
mp-1223484
10.626456
11.556722
-2.97769
other
K2V6Pb8O24
40
173
698.87
mp-17486
-2.959833
-2.452415
-6.028758
other
Ho6Cu2Si2S14
24
173
479.2
mp-866516
-2.808511
-2.579841
-5.326722
other
Ce6Al2Cr2S14
24
173
527.43
mp-556962
-2.819039
-2.566979
-5.818387
other
Pr6Cu2Ge2S14
24
173
538.04
mp-557517
-2.819703
-2.575351
-5.885988
other
Tb6Cu2Ge2S14
24
173
496.73
mp-1208932
7.279381
8.55628
-1.56615
other
Sr2Ca6Yb18O36
62
173
919.39
mp-555509
-2.902068
-2.490251
-5.917408
other
Ho6Cu2Ge2S14
24
173
483.3
mp-1209461
10.967446
11.073544
-2.382589
other
Rb4W6Se2O24
36
173
555.62
mp-866500
-2.866199
-2.59659
-5.323491
other
Ce6Mn2Al2S14
24
173
526.01
mp-1228113
13.026401
5.738144
-5.530409
other
Ba10P6O24F2
42
173
722.25
mp-732235
11.415977
6.880688
-0.131009
other
Ca4Y6Si6O26
42
173
537.15
mp-510566
-2.833988
-2.406775
-5.738448
other
La6Cu2Sn2S14
24
173
566.97
mp-542806
-4.243976
-3.871326
-3.451178
other
Ce6Cu2Sn2Se14
24
173
621.88
mp-560014
-2.805002
-2.521838
-5.83624
other
Pr6Cu2Sn2S14
24
173
556.38
mp-559272
10.595536
9.236402
-0.662662
other
K6Sb14S6O18
44
173
1,056.3
mp-1192232
-2.899687
-2.477003
-5.750943
other
Sm6Ga2Ni2S14
24
173
509.17
mp-863386
12.820893
7.609842
-7.328421
other
Li18Co18P18O72
126
173
1,531.91
mp-1211398
-2.745391
-2.501838
-5.781066
other
La6Be2Ga2S14
24
173
535.68
mp-1220062
11.8325
6.86794
-4.206521
other
P6Pb10Br2O24
42
173
670.18
mp-617632
-2.801589
-2.449621
-5.719416
other
La6Ag2Ge2S14
24
173
565.59
mp-1209065
9.743976
8.505888
3.144254
other
Sr2Ca6Lu18O36
62
173
864.27
mp-864666
-2.935704
-2.497268
-5.919697
other
Nd6Si2Ag2S14
24
173
531.29
mp-555978
-2.951072
-2.48765
-5.774969
other
Sm6Cu2Ge2S14
24
173
510.16
mp-1190730
-2.776194
-2.664129
-5.841561
other
Nd6Al2Co2S14
24
173
519.59
mp-571347
-4.30338
-3.968817
-3.783142
other
Pr6Cu2Ge2Se14
24
173
613.57
mp-757928
12.641733
7.678549
-7.492063
other
Li6Co6P6O24
42
173
466.03
mp-1227490
10.177652
4.506304
-6.050005
other
Ce2H6S6O24
38
173
492.93
mp-6485
-4.369854
-3.794653
-3.764987
other
La6Si2Ag2Se14
24
173
632.17
mp-1190483
-3.167502
-2.203607
-5.245092
other
Na2Yb6Ge2S14
24
173
510.95
mp-1193048
-2.830441
-2.636549
-5.228351
other
Ce6Ti2Al2S14
24
173
537.3
mp-1192190
-2.740037
-2.570551
-5.679999
other
Gd6Al2V2S14
24
173
500.06
mp-1223605
0.882431
1.379716
-4.2849
other
K2Pr10C4Cl20
36
173
977.87
mp-1229253
12.0695
8.053901
0.627394
other
Ca2Ce8Si6O26
42
173
579.43
mp-39460
13.390376
5.382684
-6.172019
other
Ca10P6Cl2O24
42
173
565.66
mp-1191316
-2.88025
-2.517553
-5.903424
other
Y6Be2Cr2S14
24
173
478.23
mp-569557
-4.4523
-3.91222
-3.833575
other
Dy6Cu2Si2Se14
24
173
557.42
mp-1191406
-2.965008
-2.428286
-5.947382
other
Gd6Cu2Si2S14
24
173
496.22
mp-1191504
8.177751
6.55041
-5.417503
other
Fe2S4N2O16
24
173
346.97
mp-1179227
8.628287
10.88363
-2.771903
other
Sr10Cr6Cl2O24
42
173
675.69
mp-561499
-2.878038
-2.452961
-5.86474
other
Dy6Cu2Sn2S14
24
173
515.9
mp-1191180
-2.848142
-2.497821
-5.729274
other
La6Be2Bi2S14
24
173
578.33
mp-570564
-4.251836
-3.883269
-3.457123
other
Ce6Cu2Ge2Se14
24
173
603.64
mp-16917
9.842886
9.49023
-4.255006
other
Rb2V6Se4O24
36
173
538.27
mp-1191109
-2.650469
-2.671602
-5.69641
other
La6Yb2Be2S14
24
173
552.77
mp-1213396
11.69515
7.357009
-0.608853
other
K24Ga24Ge24O96
168
173
2,719.92
mp-729185
10.871296
11.368606
-2.891577
other
V6H2Pb10O26
44
173
703.18
mp-561272
10.547973
10.245289
1.229194
other
Nd6B2W2O18
28
173
375.03
mp-753739
13.744987
8.379366
-0.947277
other
Li4V4Si4O16
28
173
452.22
mp-1191521
-2.741978
-2.63009
-5.80717
other
Pr6Mn2Ga2S14
24
173
542.5
mp-556740
13.445601
4.993329
-1.906008
other
Na18Si18B18O72
126
173
1,332.72
mp-863751
-2.837707
-2.540375
-5.920784
other
Pr6Si2Ag2S14
24
173
540.88
mp-504650
-2.882566
-2.416543
-5.900613
other
La6Cu2Si2S14
24
173
544.44
mp-1190540
-2.752385
-2.593251
-5.809816
other
Na2Nd6Ge2S14
24
173
538.71
mp-759036
14.497398
7.738028
-6.113022
other
Li2Mn10P6O26
44
173
491.39
mp-766374
11.993318
7.038456
-1.041027
other
Li6Si6Bi6O24
42
173
584.56
mp-758792
12.764543
7.423028
-1.168157
other
Li18Cr6Si12O42
78
173
828.26
mp-1191063
-2.743562
-2.611011
-5.891513
other
Pr6Be2Cr2S14
24
173
525.3
mp-1198721
10.519537
10.604378
-3.591997
other
Rb4Mo6Se2O24
36
173
554.7
mp-573114
-2.900204
-2.472856
-5.851932
other
Gd6Cu2Ge2S14
24
173
505.05
mp-1191432
-2.889799
-2.521899
-5.378397
other
Ce6Al2Cd2S14
24
173
550.08
mp-554150
-2.896634
-2.557505
-5.830678
other
Nd6Cu2Ge2S14
24
173
529.15
mp-1200850
9.073664
9.246352
-4.430463
other
V6Se4N2O24
36
173
536.93
mp-1192219
-2.765023
-2.561018
-5.863259
other
Gd6Al2Zn2S14
24
173
512.79
mp-558051
10.580714
10.113951
1.052486
other
Pr6B2W2O18
28
173
381.93
mp-570045
-4.386936
-3.9648
-3.795455
other
Sm6Cu2Si2Se14
24
173
581.52
mp-865922
8.722146
1.229948
-4.326536
other
Fe2H8Br6N2
18
173
298.66
mp-17827
-4.366629
-3.94478
-3.792608
other
Nd6Si2Ag2Se14
24
173
609.9
mp-1191886
-2.911139
-2.545626
-5.774075
other
Sm6Al2Co2S14
24
173
506.44
mp-1191235
-2.754062
-2.636014
-5.851184
other
Dy6Mn2Al2S14
24
173
483.55
mp-1194737
7.714963
0.531159
-4.034311
other
Y2B6H54N10
72
173
671.41
mp-1200352
8.469967
3.288373
-5.57493
other
In6H18C18O36
78
173
1,001.95
mp-864652
-2.797665
-2.66082
-5.830934
other
Nd6Mn2Al2S14
24
173
529.6
mp-1201715
11.450739
7.259479
-3.944579
other
Na6Zn6As6O24
42
173
611.78
mp-1192254
-2.701878
-2.701169
-5.807375
other
Tb6Al2Fe2S14
24
173
492.78
mp-1227203
11.908806
6.979128
-3.874026
other
Ca10As6Cl2O24
42
173
604.86
mp-560501
-2.876828
-2.555381
-6.005773
other
Tb6Cu2Si2S14
24
173
488.69
mp-510011
-4.370393
-3.852165
-3.731515
other
La6Cu2Ge2Se14
24
173
625.86
mp-1220871
11.203467
7.385833
-3.36341
other
Na2As6Pb8O24
40
173
674.23
mp-6566
11.506043
7.18581
-3.980431
other
Na6Zn6As6O24
42
173
566.61
mp-1211336
-2.808989
-2.5065
-5.675644
other
La6Fe2Si2S14
24
173
530.94
mp-1191579
-4.245972
-4.009472
-3.854957
other
Nd6Ga2Co2Se14
24
173
594.3
mp-1191215
-2.758754
-2.555384
-5.589814
other
La6In2Fe2S14
24
173
569.58
mp-18353
10.633631
10.607765
-3.621665
other
Cs4Mo6Se2O24
36
173
580.04
mp-558375
-3.098572
-2.390886
-5.518916
other
Ce6Cu2Si2S14
24
173
521.8
mp-1191447
-2.692196
-2.658916
-5.810422
other
Pr6Al2Ni2S14
24
173
528.14
mp-818262
8.954909
9.535602
-3.845673
other
Mo6Se2N4O24
36
173
653.16
mp-1214374
12.999386
7.5557
-4.084668
other
Bi10P6O24F2
42
173
660.95