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-1105399
10.848733
10.232109
1.557773
other
La4Mo2O10
16
87
248.4
mp-1208647
12.257365
11.31342
2.115108
other
Ta9P2O25
36
87
488.38
mp-1223871
1.2905
2.386552
-5.650408
other
K4Na1Cl5
10
87
294.77
mp-759165
5.751031
10.050756
-1.911404
other
Na16Fe4O20
40
87
507.54
mp-675989
-4.528279
-3.065514
-3.995638
other
Tl9Bi1Se6
16
87
479.16
mp-1209548
8.024443
11.503288
0.393717
other
Rb1Ru4O8
13
87
155.46
mp-1224406
-5.445056
-2.223722
-3.392368
other
K4Fe10Se10
24
87
526.47
mp-754694
11.410733
10.688654
-0.056236
other
Na4W1O4
9
87
130.02
mp-1210146
12.492194
11.229489
2.013025
other
Nb9P2O25
36
87
511.56
mp-5327
11.041576
8.81356
1.591767
other
Na4U1O5
10
87
128.72
mp-1216727
-5.883754
-4.043134
-2.210645
other
Tl9Sn1Te6
16
87
528.9
mp-755298
9.834484
11.89498
0.422285
other
Li4Nb1O4
9
87
99.67
mp-541958
12.919518
11.044276
-0.755766
other
Pr2Mo12O24
38
87
445.86
mp-1183955
-3.363909
-1.482823
-5.612091
other
Cs4H4S4
12
87
316.37
mp-1104568
-5.136319
-7.067958
3.375464
other
Ba9In4H1
14
87
594.92
mp-27660
-4.451519
-1.035087
-4.752824
other
Ba1Fe2S4
7
87
148.86
mp-7221
-5.911808
-2.637182
2.215298
other
Nb5As4Pd4
13
87
215.19
mp-626307
10.677794
6.023263
-4.245686
other
Fe4H4O8
16
87
177.75
mp-1215768
10.217006
9.776556
3.795586
other
Y1Zr4O10
15
87
176.92
mp-542069
11.151328
11.109122
2.542341
other
Cs8Ta6O19
33
87
696.46
mp-1213089
8.339715
1.824124
0.080085
other
Cs1Sb4F13
18
87
354.67
mp-15123
-1.985
0.375766
2.494575
other
Th1Al4C4
9
87
112.39
mp-1223780
-0.19389
1.480167
-4.579922
other
K5Br4Cl1
10
87
351.99
mp-1210626
8.055057
13.918365
-1.850497
other
Mn4N1O8
13
87
145.99
mp-1210521
8.077242
11.495199
0.387758
other
Na1Ru4O8
13
87
151.76
mp-732041
-0.303439
1.64687
-4.01883
other
Mo6Br12O2
20
87
717.55
mp-752473
9.851856
8.736433
3.257367
other
Sm1Th4O10
15
87
220.76
mp-1214780
8.323948
2.24612
-0.801095
other
Au2Xe2F18
22
87
355.66
mp-1198571
1.142259
1.849136
-5.445426
other
Ba8Eu7Cl34
49
87
1,415.44
mp-573974
1.39762
2.390549
-5.553126
other
Tl10Hg3Cl16
29
87
857.28
mp-1100963
-4.975623
-3.520964
0.819252
other
U10As6Se4
20
87
435.58
mp-34361
-5.899862
-4.016327
-2.156047
other
Tl9Bi1Te6
16
87
538.6
mp-10388
-5.320841
-2.11834
1.911285
other
Nb5P4Pd4
13
87
199.28
mp-28698
7.748189
10.581409
-0.309315
other
Na4Ir1O4
9
87
117.79
mp-1224192
9.334163
13.490172
-1.895139
other
K1Cr20O40
61
87
741.88
mp-27489
-4.138703
-1.298276
-5.008017
other
Ba6Fe8S15
29
87
662.73
mp-541150
8.410747
14.518653
-1.072074
other
Ba1Mn4O8
13
87
151.33
mp-2219011
6.075607
12.172397
-1.454704
other
Mg1Ni4O8
13
87
125.43
mp-1217955
-7.506478
0.263444
3.628734
other
Ta11Co104B30
145
87
1,452.36
mp-1221795
12.338768
11.692037
0.04286
other
Mn1Fe4O5
10
87
108.49
mp-19029
9.787841
13.607802
-1.400454
other
Rb1Cr4O8
13
87
151.26
mp-1003316
8.336906
14.434968
-1.390123
other
K1Mn4O8
13
87
139.31
mp-1226337
-5.520772
0.295355
3.219009
other
Cr9Fe1B6
16
87
145.5
mp-1212528
3.000419
3.019603
-4.014948
other
Hg3N10Cl16
29
87
1,327.1
mp-757206
11.824165
11.817135
2.127635
other
Ba2Ti12O24
38
87
459.87
mp-1205126
-0.14139
0.723668
-3.55012
other
Ba9Pr6Br34
49
87
1,670.37
mp-754182
10.220849
9.805172
3.831298
other
Tb1Zr4O10
15
87
176.33
mp-7714
10.249651
11.217464
0.608005
other
Li4U1O5
10
87
98.45
mp-1201513
8.743363
0.725914
1.532018
other
K15Al5F30
50
87
750.18
mp-29230
12.480371
13.352766
-1.372001
other
K1V4O8
13
87
152.97
mp-1188848
-5.952095
-4.044215
-2.028584
other
Sm1Tl9Te6
16
87
554.06
mp-1208679
8.852534
0.98565
1.520554
other
Sr10Al6F38
54
87
742.38
mp-1188567
-5.939997
-4.030584
-2.077715
other
Gd1Tl9Te6
16
87
512.61
mp-1208695
11.884944
11.553259
2.285576
other
Ta9V2O25
36
87
505.47
mp-27806
8.497828
2.70807
-1.132538
other
Ni1N2F14
17
87
204.07
mp-1223943
-3.931799
-5.813056
2.415078
other
K5C4Br1
10
87
311.69
mp-5628
8.043484
11.506464
0.40862
other
K1Ru4O8
13
87
152.12
mp-1218424
-3.980643
-5.707316
5.270988
other
Sr9Ca1Si6
16
87
510.27
mp-1077893
-5.221281
-2.377452
-3.513912
other
Ba1Fe2Se4
7
87
167.07
mp-769800
9.855302
8.828903
2.07952
other
Sr1Eu4O5
10
87
164.17
mp-14785
-4.363266
-3.927054
0.838116
other
Ba1Cu8P4
13
87
197.91
mp-27797
3.128026
-0.687245
-2.078737
other
Li4H4Rh1
9
87
79.09
mp-691129
0.232444
2.098441
2.395877
other
V5N4O1
10
87
100.7
mp-1210182
12.043758
11.390762
2.118785
other
Nb9As2O25
36
87
525.03
mp-1203801
10.908685
4.757205
-6.826344
other
U6S6O32
44
87
583.16
mp-561129
12.967959
10.91273
-0.381205
other
Pr2Mo12O24
38
87
522.51
mp-2219006
8.498173
14.476165
-1.484596
other
Mg1Mn4O8
13
87
139.36
mp-760419
8.531364
1.238099
1.081672
other
Li2Bi1F5
8
87
124.55
mp-1190972
-7.125212
-3.614038
0.784607
other
In4Pd17Se4
25
87
429.16
mp-1210227
11.959784
11.550235
2.095958
other
Nb9V2O25
36
87
516.05
mp-757832
8.273942
14.356801
-1.481839
other
K2Mn12O24
38
87
415.47
mp-1209209
8.158001
2.238936
-0.652722
other
Sb4N1F13
18
87
309.07
mp-756428
9.788342
8.761752
3.226644
other
La1Th4O10
15
87
222.25
mp-1215738
8.214145
12.13975
-0.806608
other
Zn1Ni4O5
10
87
96.12
mp-1214022
12.593335
10.79457
0.125134
other
Ca8Mo7O20
35
87
457.05
mp-1227617
9.555667
8.710808
-0.496169
other
Bi14W1O24
39
87
658.34
mp-867568
11.369001
12.230009
2.103587
other
Cs2Ti12O24
38
87
471.97
mp-9159
9.93371
11.560292
0.198956
other
Li4Np1O5
10
87
96.87
mp-760012
9.694385
13.66217
-1.503736
other
Na1Cr4O8
13
87
145.08
mp-1080446
7.84489
9.047949
-3.19063
other
K2Os1O6
9
87
169.59
mp-558775
8.734798
1.24419
1.214558
other
Al6Pb10F38
54
87
767.14
mp-2971
-4.810486
0.369378
2.958448
other
U1Cr4C4
9
87
96.5
mp-560043
8.423466
1.865582
-0.055274
other
K1Sb4F13
18
87
312.02
mp-1226911
8.939709
8.823449
2.377943
other
Ce4Sm1O10
15
87
205.79
mp-626316
10.422933
6.271399
-4.234324
other
Fe4H4O8
16
87
173.01
mp-27941
6.511712
5.910399
-3.552564
other
Ag4Cl4O12
20
87
307.06
mp-767765
-5.287388
-3.856892
-2.752417
other
Li34Sb8S7
49
87
900.92
mp-18881
9.738527
13.604342
-1.450523
other
K1Cr4O8
13
87
148.8
mp-1208659
11.819034
11.432677
2.307022
other
Ta9As2O25
36
87
513.87
mp-772510
9.876612
8.76518
3.290505
other
Y1Th4O10
15
87
218.17
mp-1197073
8.806597
1.104906
1.604843
other
Ba10Al6F38
54
87
832.53
mp-567646
1.031654
1.505979
-4.999452
other
Ba9Sm6Cl34
49
87
1,397.92
mp-10863
-6.21193
-6.463996
3.838896
other
Li4Yb5Ge4
13
87
297.06
mp-28586
8.417732
2.157215
-0.829939
other
Ag2Xe2F18
22
87
350.17
mp-767715
-5.420498
-4.053023
-2.493991
other
Li34Sb9S6
49
87
919.36
mp-2218911
12.230109
11.62881
1.941703
other
Mg1Ti4O8
13
87
155.07
mp-1219790
8.169226
11.462517
-0.852891
other
Rb2Ir12O24
38
87
488.87
mp-1227628
9.570615
8.728147
-0.559663
other
Bi14Mo1O24
39
87
650.9
mp-1097907
8.7678
13.521255
-1.587708
other
Mn4H4O8
16
87
184.54
mp-1221768
-5.100931
-0.794807
-5.274221
other
Mn4Cd1S5
10
87
184.46