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-1104269
-8.060301
-4.003593
5.290886
other
Er1Al8Cu4
13
139
198.02
mp-12783
-6.742126
-6.804289
3.470203
other
Sr1Cd2Ga2
5
139
117.18
mp-27468
1.495667
1.366824
2.452021
other
U2Bi1N2
5
139
96.56
mp-31212
8.538531
0.720513
1.608506
other
K2Mg1F4
7
139
102.54
mp-18820
5.355815
10.858075
-0.705685
other
Sr3Fe2O7
12
139
147.64
mp-1077736
-6.013426
-3.51868
4.396243
other
Ce2Ti2Ge2
6
139
131.49
mp-1069712
-6.13164
-6.323625
3.456708
other
Ba1Cd2Ge2
5
139
126.55
mp-1207113
-5.710762
-1.870666
1.324526
other
Rb1P2Rh2
5
139
105.47
mp-7600
-5.477826
-1.97968
5.76755
other
Th1Fe2Si2
5
139
77.63
mp-2954
-5.320847
-4.46581
5.137881
other
Dy1Si2Au2
5
139
91.35
mp-1223810
1.276138
2.348049
-5.669019
other
K2Na1Cl3
6
139
177.93
mp-1204608
-7.463685
-6.413476
6.008557
other
Tb22In12Si8
42
139
1,087.9
mp-4105
-5.206361
-3.940359
5.435741
other
Ho1Cu2Si2
5
139
76.84
mp-567243
-5.610763
-2.101677
5.316116
other
Tm1Cr2Si2
5
139
78.04
mp-1071889
-3.738676
-3.805838
-3.021439
other
Th2Ge2Se2
6
139
145.51
mp-1246812
1.62648
1.851422
1.300619
other
Sr2Mg1N2
5
139
102.6
mp-1189858
-3.227065
-1.630877
-5.37267
other
Ba4Hf3S10
17
139
447.58
mp-12119
-6.196206
-3.754533
0.920154
other
Cs1Fe2Sb2
5
139
128.6
mp-1226529
7.198395
8.374239
-0.643972
other
Ce1Pr2O6
9
139
134.34
mp-20924
-5.816442
-1.722992
5.33461
other
U1Fe2Si2
5
139
72.66
mp-4250
-5.656679
-4.056946
4.942811
other
Tb1Si2Pd2
5
139
85.04
mp-3286
-7.583517
-5.143482
5.4489
other
Ce1Al2Zn2
5
139
96.21
mp-3329
-7.690822
-3.260221
4.326799
other
Tb1Ni2Ge2
5
139
79.42
mp-30426
-5.929807
-6.031466
0.876872
other
Ba2Cd2Bi4
8
139
277.7
mp-574199
-5.661222
-1.632721
0.840984
other
Sm1Ni2P2
5
139
71.83
mp-19979
-7.792446
-3.363093
4.509579
other
La1Ni2Ge2
5
139
86.51
mp-1207070
-8.217801
-1.900362
3.003701
other
Ti1Cu1Ni2
4
139
48.24
mp-571008
-6.325132
-1.779264
1.295199
other
Pr1Co2As2
5
139
83.82
mp-1103929
-8.391218
-4.26184
4.634315
other
Yb1Ga8Cu4
13
139
206.2
mp-27895
-3.925173
1.710113
3.069085
other
Er4Ni4B16
24
139
235.87
mp-1210174
-5.900972
-1.775847
4.443089
other
Nb8Co8Si12
28
139
376.18
mp-19191
9.01784
10.27329
2.049043
other
Nd2Ni1O4
7
139
92.08
mp-4131
-5.883368
-2.359973
5.381814
other
Sc1Co2Si2
5
139
67.04
mp-19900
-7.845793
-2.386842
5.303864
other
La1Ge2Ru2
5
139
94.15
mp-9583
8.586772
0.853943
1.377
other
K2Zn1F4
7
139
106.65
mp-8310
-5.809163
-1.432569
0.896871
other
Li1Ni2P2
5
139
63.53
mp-5688
-5.516172
-1.870663
5.587318
other
Er1Fe2Si2
5
139
72.99
mp-8963
8.12937
0.499543
0.981636
other
Cs2Hg1F4
7
139
156.85
mp-22180
-8.10645
-4.596136
3.166571
other
Dy1Ge2Pd2
5
139
90.59
mp-557032
-3.232346
-1.621166
-5.373433
other
Ba5Hf4S13
22
139
572.97
mp-10343
-2.635113
0.537571
2.522572
other
Sc2B1C2
5
139
59.52
mp-4415
-7.909101
-2.249726
5.265388
other
Ho1Co2Ge2
5
139
76.68
mp-1068250
-5.347583
-1.800882
5.624417
other
Ca1Fe2Si2
5
139
76.9
mp-1178535
9.263291
8.606685
2.874338
other
Ba3Y2O6
11
139
212.63
mp-20171
-5.389736
-3.569599
5.236265
other
Pu1Si2Ni2
5
139
74.75
mp-567203
-5.77634
-2.319871
5.625686
other
La1Si2Os2
5
139
89.77
mp-559492
-5.323769
-1.074368
-4.30724
other
Tl1Ni2S2
5
139
91.49
mp-7882
-7.383882
-6.461741
2.825145
other
Ba1Ag2Sn2
5
139
135.76
mp-504566
8.722898
9.943291
2.361903
other
La8Co4O16
28
139
387.62
mp-4903
-5.175773
-3.952653
5.479204
other
Tm1Cu2Si2
5
139
75.93
mp-1208363
-7.348372
0.427795
5.06914
other
Tb1Al4Fe8
13
139
179.22
mp-1206959
-5.204937
-3.478375
0.903882
other
Yb1P2Pd2
5
139
83.39
mp-20704
-6.985554
-1.633883
5.951507
other
U1Mn4Al8
13
139
196.93
mp-1077953
-5.201382
-6.001346
1.747751
other
Eu4As2O1
7
139
181.25
mp-1206080
-7.112898
-4.268064
4.102217
other
Zr2Zn4Ge2
8
139
137.37
mp-1104681
-8.022199
-0.237491
4.334889
other
Nd1Mn4Co8
13
139
162.23
mp-20115
-5.477354
-4.333597
4.9417
other
Eu1Si2Pd2
5
139
89.33
mp-755609
10.872921
7.874039
2.742301
other
Y2Se1O2
5
139
90.42
mp-1227700
0.998486
1.530644
-5.147622
other
Ba1Sr4Cl10
15
139
451.44
mp-3385
-4.518131
-3.528592
0.821207
other
Sr1P2Pd2
5
139
88.28
mp-1103976
-6.648952
-1.844893
5.905763
other
Ho1Al8Cr4
13
139
200.84
mp-2881
-8.110182
-2.983196
4.503338
other
Tb1Ge2Rh2
5
139
87.07
mp-3241
-7.908337
-4.895038
4.074931
other
Sr1Cu2Ge2
5
139
92.09
mp-1219174
-8.088456
-5.395134
5.376861
other
Sm1Zn2Ga2
5
139
91.82
mp-758680
7.994849
12.338788
-0.935831
other
Mn2Ni36O40
78
139
743.43
mp-16249
-8.473587
-5.836766
2.969498
other
Th1Ge2Au2
5
139
104.69
mp-3035
-5.583288
-1.900695
5.668107
other
Ce1Fe2Si2
5
139
75.32
mp-1068246
-5.727496
-2.842589
5.760521
other
Th1Si2Ir2
5
139
90.09
mp-1103870
-7.473113
-6.670037
2.47317
other
Eu1In8Ag4
13
139
351.73
mp-1178367
9.088567
9.121027
2.456016
other
Dy2Cu1O4
7
139
88.13
mp-21221
-7.372441
-1.013031
5.495406
other
Pr1Fe2Ge2
5
139
88.94
mp-1206417
-5.148804
-3.296406
0.872257
other
Er1P2Pd2
5
139
82.78
mp-20677
-5.194216
-4.012847
5.424399
other
Gd1Cu2Si2
5
139
78.83
mp-867348
-7.407968
-6.167759
4.698127
other
Dy2Mg2Sn2
6
139
152.05
mp-4007
-5.383613
-3.473347
5.477139
other
Nd1Si2Ni2
5
139
78.09
mp-13401
-8.176845
-4.591234
4.249472
other
Yb1Cu2Ge2
5
139
85.91
mp-1068300
-5.97716
-2.229504
1.064379
other
Ca2Fe4As4
10
139
177.97
mp-1205943
3.881478
3.736634
-3.673179
other
Cu1I2N6
9
139
101.94
mp-6992
-6.257086
-2.398014
0.874572
other
Eu1Ni2As2
5
139
84.59
mp-22349
-7.355713
-0.878457
5.44643
other
Sm1Fe2Ge2
5
139
85.9
mp-19237
11.951435
10.306215
0.72304
other
Sr2Mo1O4
7
139
98.29
mp-1219180
11.270808
8.111281
2.800587
other
Sm2Sb1O2
5
139
104.64
mp-1104796
-6.852808
-1.680839
5.982319
other
Tb1Mn4Al8
13
139
198.93
mp-22306
7.280276
9.892456
0.228832
other
Eu2Cu1O4
7
139
90.82
mp-20776
-7.556674
-2.247702
4.992828
other
U1Co2Ge2
5
139
77.24
mp-530945
5.336205
10.930288
-0.888712
other
Sr16Fe16O47
79
139
960.52
mp-567427
-8.065674
-3.073649
4.317046
other
Yb1Ge2Rh2
5
139
90.15
mp-5868
8.182738
10.71418
1.252812
other
Sr3Ru2O7
12
139
158.19
mp-862763
-8.079568
-3.978384
5.300971
other
Pr1Al8Cu4
13
139
198.73
mp-8832
-5.561769
-2.201755
5.352006
other
Tb1Cr2Si2
5
139
79.69
mp-1018062
-8.025508
-2.378703
3.197266
other
Fe1Sn1Rh2
4
139
59.91
mp-4796
-6.744786
-4.566508
5.353234
other
Gd2Sc2Ge2
6
139
141.68
mp-1025236
-6.490633
-3.043329
4.479194
other
Sc1Ti2Ga4
7
139
117.14
mp-1221205
9.909426
7.708746
-2.26771
other
Na3P1O4
8
139
99.22
mp-7365
-4.753292
-4.688891
5.096045
other
Sr1Si2Au2
5
139
99.27
mp-1147780
3.321787
-0.611305
-2.477527
other
K2Cu1H4
7
139
99.31
mp-1226847
10.7725
8.637749
2.715682
other
Ce4U1O10
15
139
202.24
mp-1206853
-7.848815
-2.034897
2.853113
other
Fe1Sb1Rh2
4
139
61.21
mp-937920
-5.985938
-3.533062
-2.215141
other
In4Sb1Te3
8
139
243.69
mp-1070735
-5.391222
-2.336004
-3.372326
other
K1Fe2Se2
5
139
106.7