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-1211568
-7.096933
-6.488482
6.574841
other
La8Os2
10
227
376.71
mp-548
-6.392743
-1.109687
4.155826
other
Nb2Cr4
6
227
83.14
mp-1532
-8.890401
-1.521643
2.85217
other
Np2Ni4
6
227
88.24
mp-1207484
-5.654167
-3.969662
3.898945
other
Zr8Fe2
10
227
230.67
mp-675
-6.069139
-1.427763
3.933395
other
Zr2W4
6
227
111.42
mp-1212367
-5.744895
-4.149261
4.056178
other
Hf8Fe2
10
227
220.85
mp-31184
-7.286307
0.409554
4.521014
other
Al2Fe4
6
227
75.28
mp-2031
-5.235888
-1.46157
4.396129
other
Be4Cu2
6
227
53.02
mp-1422
-8.334798
-3.477478
2.651359
other
Gd2Pt4
6
227
113.3
mp-2676
-5.271315
-1.484822
4.491153
other
Ta2Be4
6
227
69.03
mp-1209093
-7.180033
-6.928085
7.082493
other
Sm8Mg2
10
227
368.31
mp-1215017
-4.507214
-2.126287
4.222809
other
Be52W4
56
227
633.58
mp-1076939
-7.572123
-0.94969
5.645891
other
Gd2Mn4
6
227
96.27
mp-16720
-6.797289
-4.638921
6.110353
other
Th2Al4
6
227
129.53
mp-929
-8.009893
-1.197471
4.46591
other
Zr2Co4
6
227
83.6
mp-2363
-5.785185
-1.666012
3.806211
other
Hf2Mo4
6
227
107.69
mp-2389
-8.023306
-8.846745
6.84838
other
Nd2Mg4
6
227
162.66
mp-1390196
-5.558953
-1.372003
-3.090625
other
Co4Se8
12
227
228.74
mp-1209511
-7.423408
-6.8518
7.345426
other
Pr8Os2
10
227
366.3
mp-1207778
-7.477258
-6.727149
6.994025
other
Y8Rh2
10
227
320.53
mp-1207616
-6.130552
-7.332841
4.19039
other
Yb8Rh2
10
227
361.89
mp-1201271
-9.381241
-5.531555
3.485274
other
Hf2Zn44
46
227
672.89
mp-1210757
-7.87538
-6.432332
6.72376
other
Lu8Rh2
10
227
294.74
mp-1103820
-3.748398
-1.676376
-3.753738
other
Zr6S8
14
227
313.27
mp-30764
-8.348592
-3.243524
2.65117
other
Li2Pt4
6
227
100.38
mp-1463
-8.643873
-2.636085
4.185269
other
La2Ir4
6
227
114.56
mp-1404610
-5.260559
-0.55795
-4.318685
other
Fe4S8
12
227
200.9
mp-2019
-7.932754
-1.76302
4.852443
other
La2Ru4
6
227
113.27
mp-570811
-5.371643
-1.272388
4.040016
other
Pr2Re4
6
227
120.4
mp-1211489
-7.365595
-6.366518
6.423521
other
La8Ir2
10
227
378.02
mp-1208177
-5.593759
-3.825107
3.650706
other
U8Co2
10
227
216.1
mp-21050
-7.44195
-0.278999
5.198599
original
U2Fe4
6
227
90.14
mp-1210799
-6.363566
-7.045499
3.20185
other
Li8Cd4
12
227
256.9
mp-745
-7.845327
-9.308512
6.411764
other
Th2Mg4
6
227
156.42
mp-1209997
-7.590721
-6.726014
6.875885
other
Nd8Pt2
10
227
361.59
mp-1215101
-4.530277
-2.023421
4.222274
other
Be52Tc4
56
227
617.92
mp-1209804
-7.224164
-6.857708
7.2821
other
Pr8Fe2
10
227
339.54
mp-1187
-8.685146
-2.844346
4.188957
other
Th2Ir4
6
227
113.54
mp-542633
-8.577732
-0.622105
5.004359
other
Gd2Co4
6
227
91.78
mp-1211397
-6.662983
-6.762154
6.50717
other
La8Al2
10
227
392.15
mp-1208467
-7.032271
-6.710407
6.865897
other
Tb8Al2
10
227
350.45
mp-1234
-7.197542
-4.479984
6.403674
other
Lu2Al4
6
227
114.68
mp-1222271
-3.799663
-5.247683
5.827766
other
Li2Si2
4
227
60.2
mp-1212928
-7.040846
-6.728818
6.600914
other
Er8Al2
10
227
337.07
mp-1212334
-7.581226
-6.647689
6.900072
other
Ho8Ni2
10
227
293.4
mp-23279
-6.045426
-5.81968
0.840012
other
K2Bi4
6
227
214.22
mp-1210982
-7.751121
-6.773455
3.511926
other
Li4Zn8
12
227
213.85
mp-30067
-6.789252
-3.264106
-0.267178
other
Te6Pd20
26
227
505.98
mp-1187198
-6.135974
-10.761186
5.737719
other
Sr2Mg4
6
227
187.74
mp-1061
-8.282344
-3.512161
2.78501
other
Pr2Pt4
6
227
118.22
mp-1210664
-7.780855
-6.512015
6.746521
other
Lu8Co2
10
227
278.02
mp-1383
-8.008958
-1.10296
4.764235
other
U2Co4
6
227
81.48
mp-1702
-8.752121
-2.622565
3.949575
other
La2Rh4
6
227
112.22
mp-1214055
-5.27825
-7.274138
3.664792
other
Ca8Rh2
10
227
382.11
mp-1207597
-5.725201
-7.405431
4.254848
other
Yb8Al2
10
227
446.81
mp-1015780
0.692389
3.0574
1.604652
other
Cr34N68
102
227
2,450.67
mp-2116
-7.15613
-1.152975
4.832902
other
Zr2Mn4
6
227
86.35
mp-570657
-4.01874
-8.455561
6.839174
other
Mg4Si2
6
227
123.42
mp-1181903
7.857417
6.893986
0.47194
other
Ca4O4
8
227
125.61
mp-1211592
-7.208958
-6.456922
6.336919
other
La8Pt2
10
227
382.73
mp-10721
-4.030996
-0.414968
3.079185
other
Ti8C4
12
227
160.4
mp-16722
-6.453571
-2.749195
6.41767
other
Al40V4
44
227
734.92
mp-1077258
-5.57623
-2.479155
3.701015
other
Nb4Cr2
6
227
111.25
mp-336
-8.760157
-0.605121
4.957776
original
Sm2Co4
6
227
95.22
mp-1210247
-5.020986
-7.300846
2.63932
other
Na8Au2
10
227
377.84
mp-640781
-6.080874
-6.829668
2.612239
other
K34In82
116
227
3,691.14
mp-1214528
-4.651716
-7.344238
3.433572
other
Ba8Al2
10
227
619.21
mp-1208
-7.104725
-4.3313
6.359191
other
Er2Al4
6
227
117.48
mp-1210792
-5.763922
-6.726198
3.976608
other
Li8Al4
12
227
223.88
mp-1001831
-3.999439
1.267094
3.5501
other
Li2B2
4
227
28.09
mp-1307
-6.372026
-6.86223
4.009868
other
Li2Ga2
4
227
58.49
mp-391
-7.059018
-4.391515
6.397191
other
Ho2Al4
6
227
118.77
mp-1214129
-5.139358
-7.244429
3.653478
other
Ca8Ni2
10
227
367.08
mp-825919
9.135384
10.952346
-3.061414
other
W4O14
18
227
265.28
mp-22460
-6.672744
-6.996983
3.257573
other
Li2In2
4
227
79.13
mp-1210201
-7.320513
-6.773065
7.052525
other
Nd8Ni2
10
227
332.96
mp-514
-7.511062
-4.563963
3.966875
other
Hf2Zn4
6
227
96.55
mp-1349
-7.989921
-3.380637
2.501147
other
Sr2Pt4
6
227
120.04
mp-1212276
-7.778871
-6.577793
6.713869
other
Ho8Pt2
10
227
327.11
mp-30822
-6.613465
-3.329304
3.301176
other
Pu2Os4
6
227
103.92
mp-1401382
9.957478
9.58323
-0.236056
other
Sn4O8
12
227
185.12
mp-2290
-8.688864
-2.548211
3.970454
other
Nd2Rh4
6
227
110.16
mp-2665
-7.939122
-1.770679
4.819098
other
Pr2Ru4
6
227
112.64
mp-540003
5.455128
11.279742
-2.514796
other
Fe4O8
12
227
135.66
mp-1210281
-5.053514
-7.348036
2.698126
other
Na8Ag2
10
227
402.47
mp-646926
-7.859086
-1.763213
4.871753
other
Gd2Ru4
6
227
107.41
mp-574438
-7.882416
-1.915244
4.885005
other
Th2Ru4
6
227
111.61
mp-2483
-7.442795
-1.081104
5.542634
other
Dy2Mn4
6
227
94.14
mp-2235
-8.629912
-2.546292
3.862979
other
Yb2Rh4
6
227
105.51
mp-16479
-3.417952
-2.082975
-4.947207
other
Yb2S4
6
227
120.22
mp-1214438
-4.838637
-7.187395
3.340221
other
Ba8Pd2
10
227
602.16
mp-568171
-7.263152
-6.590694
6.747541
other
Nd4Al2
6
227
181.98
mp-2271
-8.152208
-3.168574
2.784486
other
Na2Pt4
6
227
105.67
mp-850
-9.059667
-1.409572
3.157672
other
Sc2Ni4
6
227
80.5
mp-1184321
-6.661764
-9.54501
5.797824
other
Eu2Mg4
6
227
175.47
mp-570436
-8.48743
-2.71592
3.812254
other
Ca2Ir4
6
227
107.26
mp-20456
-5.475778
-1.415969
-3.042992
other
Co6Se8
14
227
247.93
mp-1038
-9.463892
-4.50464
3.84772
other
Mg2Cu4
6
227
84.37
mp-1077346
0.670228
0.982183
-1.379617
other
Hg4N2
6
227
272.67
mp-1210139
-5.348336
-4.7914
4.293437
other
Np8Fe2
10
227
215.98