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-1102921
-5.713098
-0.494387
3.568556
other
Re8W4
12
194
191.42
mp-30841
-8.119185
-4.223856
2.857029
other
U4Pd12
16
194
283.24
mp-862689
-4.119291
-6.710408
1.450274
other
Cs6Rb2
8
194
925.12
mp-12109
-5.685614
-1.20743
4.145301
other
Zr4Re8
12
194
209.37
mp-980109
-8.418537
-5.861581
2.028034
other
Sn2Au6
8
194
153.19
mp-15668
-4.744784
-2.807329
-3.896694
original
Na4Se4
8
194
201.39
mp-1187525
-5.270654
-2.925941
4.031477
other
Ti6Si2
8
194
123.73
mp-1014246
-4.327533
0.127327
3.082878
other
Zr2B2
4
194
59.3
mp-1186984
-0.522232
0.823882
-3.852863
other
Sc2Br6
8
194
300.27
mp-30866
-7.43659
-1.623638
3.404859
other
Rh6W2
8
194
112.84
mp-1187839
-5.705648
-4.636792
3.369238
other
Tm2Pu6
8
194
225.63
mp-1186836
-5.977108
-4.524949
3.078582
other
Pu6Zn2
8
194
190.26
mp-21068
-6.446598
-6.933042
3.680434
other
Ca2In4
6
194
162.65
mp-975109
-4.648516
-7.319873
2.660982
other
Rb2Na6
8
194
411.06
mp-1184791
-8.076566
-2.442047
3.535586
other
In2Rh6
8
194
121.44
mp-972002
-6.373158
-8.026242
5.652819
other
Ac6Yb2
8
194
350.28
mp-12553
-7.013505
-4.439634
6.400498
other
Pr2Al6
8
194
171.97
mp-1188053
-5.632107
-3.758262
3.935663
other
Zr6Ta2
8
194
177.39
mp-1072113
-4.565011
-0.856117
-3.078572
other
Nb2Se4
6
194
142.9
mp-559740
15.621602
5.625771
0.384893
other
Si12O24
36
194
887.73
mp-1186353
-6.897621
-6.836821
7.176514
other
Nd6Np2
8
194
278.21
mp-1185272
-5.663897
-6.915874
3.922213
other
Li6Sm2
8
194
195.93
mp-867352
-7.599736
-1.726697
3.520249
other
Tc2Rh6
8
194
110.52
mp-1102767
-7.490772
-8.826105
6.205251
other
Ce4Mg8
12
194
366.43
mp-1186704
-7.569271
-6.817772
7.032905
other
Pr6Ag2
8
194
246.03
mp-865301
-0.550596
0.699644
-3.776948
other
Tm2Br6
8
194
316.46
mp-1190852
-3.8332
-4.814796
5.90508
other
La2Si20
22
194
377.9
mp-862668
-7.92633
-7.87304
3.14763
other
Ce2Hg6
8
194
203.97
mp-1077243
-4.174992
-7.091746
3.036562
other
K4Zr2
6
194
293.51
mp-570786
-4.691569
-7.408821
2.738399
other
K4Na8
12
194
587.28
mp-786
-6.525655
-3.023895
0.686035
other
Mn2Sb2
4
194
86.48
mp-1186212
-5.342263
-4.803337
4.426332
other
Np6Au2
8
194
158.14
mp-985288
-5.966228
-2.0543
1.498712
other
As6W2
8
194
146.79
mp-1187109
-5.047422
-7.443877
3.654702
other
Sr6Ac2
8
194
409.44
mp-1191108
-8.792303
-2.406121
3.887774
other
Sm6Rh18
24
194
420.03
mp-1187062
-5.981302
-5.742497
5.864043
other
Th6Se2
8
194
227.65
mp-864994
-8.011188
-8.188798
2.997407
other
Dy2Hg6
8
194
186.68
mp-20686
-8.088233
-6.606119
6.112069
other
Ho4In2
6
194
164.82
mp-1183359
-4.707689
-7.302975
3.726611
other
Ba6Er2
8
194
413.03
mp-7956
-5.150787
-6.250088
0.731528
other
Na6Sb2
8
194
232.18
mp-1102895
-6.541728
-3.577847
3.571337
other
Ta4Zn8
12
194
181.08
mp-662
-5.568961
-1.709866
-3.177388
other
Ni2Se2
4
194
60.78
mp-1039262
-8.10376
-6.743463
3.870684
other
Ca2Zn6
8
194
158.14
mp-2346983
10.15773
9.057437
0.091954
other
Zn2O2
4
194
66.76
mp-1186780
-5.485114
-7.424416
4.079031
other
Sr2Yb6
8
194
356.26
mp-1005761
-7.185095
-6.935901
7.131149
other
Sm2Gd6
8
194
274.6
mp-1184721
-8.012394
-0.932599
4.169863
other
Hf2Co6
8
194
104.5
mp-865428
-4.097662
-3.794136
0.970661
other
U2P6
8
194
134.12
mp-864934
-8.01901
-6.789922
2.168582
other
Mg2Ag6
8
194
139.68
mp-13138
-9.067958
-4.763138
3.267007
other
Cu6Sn2
8
194
112.21
mp-1183863
-6.680501
-7.195286
7.140659
other
Ce2Pm6
8
194
279.06
mp-1184475
-5.423397
-7.450724
4.34179
other
Eu6Y2
8
194
323.79
mp-863035
-5.972448
-4.361189
1.305009
other
Pu2Sb6
8
194
216.63
mp-1094023
-4.976807
-0.098515
3.01036
other
V4C2
6
194
69.69
mp-863658
1.262845
2.068189
-5.242354
other
Pm2Cl6
8
194
279.52
mp-1185205
-6.852218
-7.351508
3.014418
other
Li6Hg2
8
194
139.65
mp-1039123
-5.541562
-7.309347
3.558328
other
Ca2Zn2
4
194
145.07
mp-1181447
3.303864
-0.626423
-2.290697
other
Eu2H4
6
194
75.99
mp-1185998
-5.486892
-3.524902
3.64292
other
Mg2Ta6
8
194
148.4
mp-1184122
-7.67854
-6.482509
6.78785
other
Dy6Al2
8
194
211.61
mp-999197
1.379558
2.247776
-0.362182
other
Ag2N2
4
194
49.85
mp-973815
-5.573915
-5.09546
5.295528
other
Pa6Ta2
8
194
188.97
mp-1183960
-5.111848
-7.470628
3.883472
other
Ca6Eu2
8
194
355.18
mp-1187462
-5.622202
-4.394758
4.126638
other
Th2Zr6
8
194
206.53
mp-1187592
-5.991163
-1.161292
4.208294
other
Tc6Pb2
8
194
133.35
mp-2178
-7.294139
-5.58632
4.520141
other
Yb2Ga4
6
194
123.76
mp-1196012
-7.741359
1.032073
5.058227
other
Y4Fe34
38
194
516.27
mp-1019316
-0.101817
1.973377
2.275025
other
Tc4N2
6
194
66.89
mp-224
-6.087599
2.247172
-5.410618
other
W2S4
6
194
113.96
mp-1184779
-7.165085
-6.621683
6.768942
other
Ho2Er6
8
194
246.97
mp-980429
-7.785338
-6.835216
6.974048
other
Sm6Hg2
8
194
232.28
mp-30489
-7.74215
-7.104997
3.191918
other
La4Cd34
38
194
871.14
mp-1187847
-7.080705
-6.594967
6.768741
other
Y2Er6
8
194
250.84
mp-570184
-8.56291
-4.50643
2.52219
other
Th4Pd12
16
194
297.15
mp-1185099
-7.010734
-7.530812
1.735969
original
K2Hg6
8
194
239.15
mp-1187290
-5.388722
-7.394024
3.860296
other
Sr2Eu6
8
194
384.83
mp-865045
-7.325847
-1.200421
4.166038
other
Mn2Ru6
8
194
108.28
mp-1079494
-4.380657
-0.301025
3.100768
other
Re4C4
8
194
82.22
mp-1187318
-7.071815
-6.765309
7.175755
other
Tb6Pr2
8
194
274.45
mp-12659
-6.889362
-1.419032
4.495385
other
Mn8Nb4
12
194
177.97
mp-864617
-1.305838
1.791459
-1.906495
other
Nd2I6
8
194
437.01
mp-1103797
-5.439453
-1.609397
3.997824
other
Pu4Re8
12
194
215.47
mp-1183362
-4.728158
-6.62554
2.021016
other
Ba6Bi2
8
194
356.75
mp-567590
-7.781359
-2.136598
4.645653
other
Lu4Os8
12
194
207.94
mp-1006132
-5.620304
-4.033588
3.749487
other
Hf6Pb2
8
194
175.88
mp-426
-5.361537
-1.547343
-3.339926
other
Co2Se2
4
194
58.69
mp-865733
-6.07327
-0.674828
3.976941
other
Co2Tc6
8
194
105.31
mp-554462
-4.000764
-0.55205
-3.775667
other
Ti2S2
4
194
59.46
mp-1183526
-6.084482
-6.914675
2.44137
other
Be2Pb6
8
194
213.41
mp-866161
-7.786262
-1.687817
3.532859
other
V2Rh6
8
194
107.77
mp-30640
-7.750281
1.027686
5.030219
other
Tm4Fe34
38
194
505.15
mp-1183957
-6.082394
-8.019924
5.219583
other
Cs2Ac6
8
194
404.31
mp-978255
-5.315051
-3.007625
4.050297
other
Mg2Ti6
8
194
144.23
mp-1102249
-5.486679
-1.264245
4.112314
other
Tb4Re8
12
194
224.29
mp-1188073
-5.853793
-3.741305
3.918962
other
Zr6Ni2
8
194
155.95
mp-1102649
-7.575662
-1.145738
5.557869
other
Tb4Mn8
12
194
204.65
mp-1187362
-7.578796
-1.964498
4.562977
other
Tb2Os6
8
194
137.88
mp-867232
-6.978621
-4.371551
6.457909
other
Tb2Al6
8
194
156.47
mp-982729
-6.96818
-6.888063
7.338026
other
Sm6Np2
8
194
256.87
mp-1186700
-7.058566
-6.656146
6.919141
other
Pr6Br2
8
194
252.46