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-1215611
-5.843059
-7.373434
4.572639
other
Yb8Al3Ga1
12
160
366.18
mp-530852
12.792905
6.944889
-0.63509
other
Mg20Si10O40
70
160
686.22
mp-1222115
-8.054789
-6.795448
2.385723
other
Mg7Ga1Ag12
20
160
363.47
mp-30925
6.310627
4.967914
-4.568008
other
La1N3O6
10
160
137.49
mp-4182
-5.571451
-0.281672
-5.864145
other
Cr1Ag1S2
4
160
73.19
mp-1235941
12.826721
11.265323
1.545612
other
Li1Ti1O2
4
160
38.52
mp-755018
10.610075
11.524158
3.255087
other
Rb1Ta1O3
5
160
68.5
mp-1097000
-4.107398
-1.394976
-5.75316
other
In1Ag1S2
4
160
90.27
mp-1220858
-7.013023
-0.82824
3.849466
other
Nb3Co8Si1
12
160
148.86
mp-1207095
-2.9062
-3.93169
0.836797
other
Si1P1Au1
3
160
60.86
mp-1078140
-4.908891
-2.752035
-3.892303
other
Mn1In2Se4
7
160
206.08
mp-1048892
12.871479
12.41729
-0.596792
other
V8Zn4O16
28
160
316.51
mp-23011
6.664568
5.782333
-3.385708
other
Rb1Cl1O3
5
160
95.64
mp-1224339
-5.737747
-3.424333
-2.060841
other
Ge1Sb1Te3
5
160
151.3
mp-1096985
-4.63937
-1.208437
-6.012864
other
Ga1Cu1S2
4
160
71.2
mp-22988
1.475335
2.741004
-5.928512
other
Cs1Ge1Cl3
5
160
162.93
mp-1185669
-6.012691
-8.317849
5.825121
other
Mg16Al12O1
29
160
587.26
mp-770710
8.126464
14.311394
-1.435975
other
Li3Mn7O16
26
160
278.64
mp-531960
8.261402
13.38865
-1.027545
other
Zn10Fe20O40
70
160
780.26
mp-1079692
7.744164
4.159955
-5.979715
other
Y1C3O6
10
160
127.6
mp-1216189
12.727779
11.42079
-0.985081
other
W1N1O1
3
160
42.28
mp-1183866
-6.249661
-8.254963
5.801211
other
Ce1Mg16Al12
29
160
592.51
mp-1215446
-5.22495
-2.449034
-5.512221
other
Zn2Se1S1
4
160
84.41
mp-1221505
-6.136589
-3.220635
-2.121274
other
Mn1Zn1Te2
4
160
121.42
mp-1219230
-8.694126
-0.114363
4.46485
other
Sm2V1Co16
19
160
247.64
mp-1185278
-6.22852
-8.23834
5.789359
other
Gd1Mg16Al12
29
160
586.64
mp-1221500
-5.356523
-2.617633
-3.951802
other
Mn1Zn1Se2
4
160
96.83
mp-1185735
-6.204031
-8.241438
5.79904
other
Mg16Zr1Al12
29
160
579.02
mp-555345
-5.733972
-0.376039
-5.687699
other
Cr1Cu1S2
4
160
59.81
mp-2219361
-5.439607
-0.152289
-5.694149
other
Mg1Cr4S8
13
160
245.59
mp-1225261
-3.92289
-1.679314
-5.584911
other
Eu1Cd3S4
8
160
226.42
mp-1232421
-5.99992
-8.382773
5.71548
other
Mg16Al12Tl1
29
160
594.41
mp-1226846
-6.02054
-3.385464
-2.504638
other
Cd5Te4S1
10
160
342.78
mp-1217260
-6.121168
-2.343826
1.885948
other
Ti5Fe4Sb4
13
160
216.07
mp-1223955
-5.394317
-2.916702
-3.311637
other
Hg2Te1S1
4
160
127.7
mp-1222587
-6.550483
-7.09309
3.159233
other
Li5Tl1In1
7
160
127.83
mp-1219244
-7.736846
0.98165
5.100338
other
Sm2Cr1Fe16
19
160
260.87
mp-1044703
11.193027
9.357677
0.257583
other
Zn2Sn4O8
14
160
202.86
mp-1096972
-4.208503
-1.247792
-5.842953
other
Ga1Ag1S2
4
160
78.48
mp-1226591
-9.260696
-5.903482
4.332493
other
Ce1U1Zn17
19
160
310.23
mp-2210682
-4.634709
-0.31577
-5.408828
other
Mg1V1S2
4
160
70.06
mp-1222443
-6.995485
-7.208883
3.197628
other
Li4Zn1Cd3
8
160
139.17
mp-1215821
-8.402258
-0.574352
4.639601
other
Y1Zr2Co9
12
160
162.8
mp-1068985
2.544132
2.727948
-4.518041
other
Sn1C1Cl3
5
160
119.78
mp-540656
-2.380366
-0.259908
-4.604284
other
Sb1S24I3
28
160
849.16
mp-754512
2.658749
2.357057
1.581318
other
Ge11N11O5
27
160
290.96
mp-676894
12.69185
9.386518
1.864457
other
Nb40N17O17
74
160
887.11
mp-550593
8.983874
3.257864
-7.720603
other
Li4C1O4
9
160
73.13
mp-1222809
-7.906864
-1.855723
4.866739
other
La1Th3Ru8
12
160
228.42
mp-1219541
-5.389415
-0.278491
3.247912
other
Re1Mo2C1
4
160
53.62
mp-1237991
9.225321
7.463398
-3.828415
other
Ge7H4O22
33
160
489.18
mp-1018084
-6.288446
-2.901042
-1.94444
other
Cr1Ag1Te2
4
160
106.3
mp-1227306
1.077477
1.149012
1.097364
other
Ba1Sr1N1
3
160
98.65
mp-1245754
0.932052
2.287649
1.977401
other
K1Ru1N1
3
160
52.39
mp-530513
13.083189
8.684357
-0.14465
other
Al16Fe8O32
56
160
559.71
mp-1223842
-4.721181
-2.919977
-3.685735
other
In1Bi1Se3
5
160
146.71
mp-1094026
9.838836
8.868201
2.925309
other
Y9Ag3O15
27
160
430.79
mp-1220091
-7.741416
1.015148
5.102389
other
Nd1Sm1Fe17
19
160
263.51
mp-1226094
-8.000385
-1.969584
2.901071
other
Co1Ni1Pt2
4
160
55.63
mp-34355
-4.964481
-5.182966
0.573273
other
Li31Zr2As13
46
160
756.46
mp-1224374
2.425218
2.88834
-3.903568
other
Ge1N1Cl3
5
160
270.45
mp-1225707
-5.821187
-3.467088
-1.951263
other
Cu1Sb1Te2
4
160
118.82
mp-1173598
1.01528
1.530866
-5.155379
other
Sr15La2Cl36
53
160
1,506.74
mp-531268
12.925253
12.599321
-0.624429
other
Mn8V16O32
56
160
635.38
mp-770959
10.125692
8.163069
1.48436
other
Ba9Ge3O15
27
160
540.66
mp-1178562
6.789366
6.068655
-3.172073
other
Ag1Br1O3
5
160
77.27
mp-1040810
11.303355
12.871528
0.062076
other
Ca4Cr8O16
28
160
352.65
mp-1223932
-5.471282
-3.177739
-2.992004
other
Hg2Te1Se1
4
160
130.48
mp-753763
9.695562
8.705277
3.163385
other
Ce5Dy2O13
20
160
282.33
mp-1219964
-9.180136
-1.496975
2.801482
other
Pr2Mg1Ni9
12
160
173.84
mp-1228401
-6.396018
-5.100937
5.483002
other
Ca3Gd1Al8
12
160
256.14
mp-8612
-5.280513
-3.530995
-2.485862
other
Sb2Te1Se2
5
160
149.37
mp-2218931
10.582101
13.363428
-1.37113
other
Mg1Cr4O8
13
160
146.47
mp-2218451
6.434157
13.402284
-2.257773
other
Mg1Co4O8
13
160
142.52
mp-1216772
-7.425468
-0.433989
3.548713
other
V2Co9Mo1
12
160
133.91
mp-1227011
-3.445413
-3.789364
0.602824
other
Cd3Cu2P10
15
160
289.12
mp-1224758
-7.326713
0.797638
3.652368
other
Fe23B3C3
29
160
292.04
mp-1078069
-4.290111
-1.31271
-6.056692
other
Al2Zn1S4
7
160
144.43
mp-1223400
1.626347
2.554801
-4.762705
other
K1Nb1Cl6
8
160
246.33
mp-1185643
-6.074495
-8.43964
5.636073
other
Mg16Al12Ag1
29
160
581.53
mp-1185706
-6.036618
-8.423343
5.774411
other
Mg16Al12Si1
29
160
578.93
mp-1181637
7.138067
7.994333
-3.51506
other
Fe3S2O15
20
160
250.02
mp-1220669
-7.231013
-0.811737
3.974185
other
Nb3Al1Co8
12
160
150.72
mp-22949
9.20161
10.940901
-0.140243
other
Fe2Bi2O6
10
160
133.65
mp-554868
-5.33432
1.134948
-4.38449
other
Al1Mo4S8
13
160
236.71
mp-1225066
-6.996278
-4.449135
6.413955
other
Gd3Er3Al18
24
160
470.09
mp-1219785
-8.827488
-0.072481
4.492291
other
Pr1Sm1Co17
19
160
245.65
mp-1216183
-8.656643
-0.422732
4.928225
other
Y3V1Co8
12
160
173.9
mp-1225085
-7.223239
-0.685319
3.015541
other
Fe3Ni3Ge2
8
160
93.92
mp-705845
6.515003
10.450299
-0.96671
other
Ba4Fe4O12
20
160
415.52
mp-1185701
-6.257424
-8.50232
5.849545
other
Mg16Al12Re1
29
160
570.82
mp-1290660
6.542754
13.197242
-2.457277
other
Ti2Co6O16
24
160
285.69
mp-1219342
-7.719813
0.820795
5.262606
other
Sm2Zr1Fe16
19
160
269.97
mp-1100373
-3.358365
-1.795322
-5.615549
other
Ca9Sn3S15
27
160
744.98
mp-4559
8.585762
3.628042
-6.898819
other
Ba1C1O3
5
160
75.08
mp-1185658
-6.120756
-8.357263
5.706721
other
Mg16Al12Cr1
29
160
575.23
mp-1221510
-5.263985
-2.77687
-4.150439
other
Mn1Zn4Se5
10
160
241.01
mp-753355
9.669147
8.776733
3.176209
other
Ce5Y2O13
20
160
283.42
mp-760795
12.534551
7.574997
0.522575
other
Al10Zn1O16
27
160
258.15
mp-1217496
-7.794021
0.274933
5.587504
other
Th3Sc3Fe18
24
160
365.48