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-1185268
-5.80917
-6.82125
3.924052
other
Li6Sc2
8
194
165.88
mp-1019322
-9.526173
1.989529
-4.060848
other
Te4W2
6
194
163.09
mp-13499
-7.89002
-9.184741
6.808435
other
Ho4Mg8
12
194
305.2
mp-1186332
-7.275832
-6.914592
7.294937
other
Nd2Tm6
8
194
256.67
mp-1186541
-6.862644
-7.229278
7.21423
other
Pm6Sm2
8
194
279.15
mp-1183100
-6.647881
-7.973227
5.283899
other
Ac6Cd2
8
194
311.24
mp-1102427
-7.385084
-1.222403
5.541501
other
Pr4Mn8
12
194
224.72
mp-1019272
1.004546
1.998866
2.225527
other
Ta2N4
6
194
63.43
mp-1095545
-5.998283
-1.598842
4.207199
other
Zr4Tc8
12
194
204.25
mp-1039075
-6.902095
-9.118052
2.467898
other
Mg6Bi2
8
194
193.5
mp-570596
-9.260594
-1.18894
2.751711
other
Nd4Ni34
38
194
483.97
mp-610
-6.165061
-2.205016
0.994536
other
Mn4As4
8
194
139.13
mp-30855
-7.835333
-3.357632
2.680319
other
U2Pt6
8
194
142.81
mp-1183103
-6.16668
-7.991648
5.863882
other
Ac6Dy2
8
194
334.44
mp-1184888
-7.893431
-9.370492
6.72913
other
Ho2Mg6
8
194
196.53
mp-1018850
-4.483859
-0.242324
2.817306
other
Os2C4
6
194
57.33
mp-1186542
-6.834802
-7.250862
7.233423
other
Pm6Tm2
8
194
270.92
mp-1184996
8.445066
3.031502
1.871456
other
La2F2
4
194
90.2
mp-30842
-8.416778
-4.497828
2.451548
other
Zr4Pd12
16
194
256.65
mp-1186241
8.746365
10.173996
-1.930533
other
Nb2O6
8
194
72.09
mp-1202187
-9.241892
-1.170733
2.768437
other
Ho4Ni34
38
194
473.55
mp-1186318
-7.535782
-6.799471
7.14021
other
Nd2Lu6
8
194
250.54
mp-973199
-5.649365
-5.50968
0.559454
other
Sb6Pb2
8
194
231.97
mp-1187407
-3.837914
-0.951367
-4.594296
other
Te2S6
8
194
172.66
mp-1187129
-4.886141
-7.615739
3.487434
other
Sr6H2
8
194
357.56
mp-1186408
-4.749716
-4.051016
5.771552
other
Pa2Si6
8
194
134.64
mp-1183907
-3.892309
-6.596305
1.726593
other
Cs6Si2
8
194
467.12
mp-999318
-6.482387
-4.155398
0.246156
other
Ni2Bi2
4
194
77.01
mp-867838
-8.658889
-6.166573
2.336941
other
Ac2Au6
8
194
194.65
mp-1187157
1.39768
2.352151
-5.108136
other
Sr2Cl6
8
194
199.14
mp-1246153
0.682061
1.208297
2.758339
other
Ti6N4
10
194
116.01
mp-1025503
-6.73967
-0.518231
3.807806
other
Cr6Co2
8
194
91.36
mp-558139
-4.926267
-1.343017
-5.637078
other
Cu2S2
4
194
59.82
mp-1101878
-7.840717
-1.713994
4.846787
other
Dy4Ru8
12
194
215.06
mp-501
-4.673125
-0.932311
-2.919384
other
Ta4Se8
12
194
277.58
mp-978963
-5.41597
-2.884883
4.003539
other
Ti6Be2
8
194
119.71
mp-1186841
-3.839935
-7.066195
2.10979
other
Rb6Dy2
8
194
533.32
mp-1184324
-7.035905
-0.861995
2.590714
other
Fe6Sb2
8
194
113.95
mp-1183749
-7.499253
-1.374856
3.627888
other
Cr2Ir6
8
194
110.1
mp-1185475
-7.626831
-6.74864
6.759664
other
Lu6Mg2
8
194
221.29
mp-999300
1.119053
2.517946
0.695896
other
Pd2N2
4
194
88.38
mp-1183357
-4.702714
-7.283429
3.650318
other
Ba6Sm2
8
194
420.87
mp-1102182
-7.568434
-1.203995
5.581557
other
Lu4Mn8
12
194
181.94
mp-1187241
-7.808732
-1.936989
3.810029
other
Ta2Ir6
8
194
119.07
mp-19854
-7.717243
-6.685716
6.224584
other
Pr4In2
6
194
191.08
mp-976812
-9.373371
-6.045522
4.29881
other
Pr4Zn34
38
194
609.81
mp-972063
-6.214186
-5.063076
4.074109
other
Yb2Ge6
8
194
163.6
mp-985506
-6.5811
-8.102121
5.232521
other
Ac6Tl2
8
194
309.23
mp-1094760
-7.757827
-9.210104
6.350166
other
Ce2Mg6
8
194
211.38
mp-1185121
-8.884078
-6.383752
4.892714
other
La2Zn6
8
194
169.31
mp-810
-6.419824
-2.826647
0.737732
other
Ni2Sb2
4
194
68.42
mp-982778
-7.971157
-5.65959
2.987224
other
Zn6Se2
8
194
143.31
mp-982013
-4.90312
-7.31655
3.922891
other
Sr6Tm2
8
194
369.02
mp-581920
-7.877647
-7.104546
3.756107
other
La26Cd116
142
194
3,558.29
mp-972416
-7.467662
-6.804407
7.126568
other
Tm6Lu2
8
194
239.45
mp-1095124
-7.133531
-0.576941
3.752436
other
Ta2Co6
8
194
93.38
mp-1187249
-6.581068
-6.676067
6.333815
other
Sr2La6
8
194
327.34
mp-979985
-8.652566
-6.154088
2.481173
other
Yb2Au6
8
194
159.82
mp-1187391
-5.852023
-0.955255
3.918725
other
Tc6C2
8
194
101.07
mp-1186934
-3.241549
-0.808215
-4.612493
other
S6Cl2
8
194
198.74
mp-976893
-6.825068
-1.962577
1.344751
other
Ni6Sb2
8
194
100.36
mp-1185113
-7.080191
-6.473909
6.173635
other
La6Cd2
8
194
258.31
mp-1214
-4.585524
-0.089604
-3.979187
other
V2S2
4
194
55.66
mp-1187948
-9.442709
-3.911053
3.059378
other
Zn6Ni2
8
194
100.91
mp-1183364
-6.046196
-8.113099
5.353012
other
Ba2Ac6
8
194
387.48
mp-22861
-6.528822
-4.461754
0.323576
other
Ni2Bi2
4
194
80.95
mp-867368
-6.107625
-7.01179
3.543641
other
Eu6Sn2
8
194
261.22
mp-13173
0.867204
2.149949
1.533641
other
Pt2N2
4
194
45.92
mp-1183754
-6.757202
-5.96654
5.486024
other
Ce6Ag2
8
194
210.5
mp-1172894
-2.928027
-8.211604
1.594911
other
Ca2Ga4
6
194
7,811.07
mp-975658
-7.176885
-6.908247
7.32811
other
Pr2Ho6
8
194
267.36
mp-1185333
-8.421313
-5.97545
2.116215
other
Li2Au6
8
194
130.97
mp-602
-8.901618
1.713541
-3.357487
original
Te4Mo2
6
194
161.28
mp-1096829
-8.396259
-2.996504
2.528335
other
B2Pt2
4
194
47.52
mp-978744
-6.364888
-5.470255
1.171743
other
Sm2Bi6
8
194
245.71
mp-1195706
-7.759264
1.021062
4.985975
other
Yb4Fe34
38
194
514.07
mp-1008500
9.214237
8.479089
1.955391
other
Ba2O2
4
194
84.03
mp-1039269
-6.535592
-5.98388
5.686369
other
Ce4Mg2
6
194
154.03
mp-1183652
-7.479986
-7.496317
1.688798
other
Cd2Hg6
8
194
199.04
mp-1187685
-6.404965
-5.574617
1.151452
other
Tm2Bi6
8
194
242.55
mp-1191777
-6.399209
-1.111594
4.153161
other
Nb8Cr16
24
194
332.6
mp-1186732
-6.757815
-6.722734
7.117508
other
Pr6Pa2
8
194
263.96
mp-1186578
-6.491322
-6.923775
6.851677
other
Pm6Np2
8
194
255.33
mp-862847
-3.778622
1.702598
2.9596
other
Pa2B6
8
194
88.36
mp-1187319
-7.052877
-6.746156
7.134144
other
Tb6Sm2
8
194
268.89
mp-1079065
-5.912358
-3.756586
3.955479
other
Zr6Co2
8
194
155.23
mp-972557
-8.429502
-7.039831
3.350461
other
Sm2Ag6
8
194
171.64
mp-1102099
-7.714436
0.034149
5.819348
other
Ho4Fe8
12
194
191.17
mp-1188129
-8.012259
-2.967112
2.624285
other
Zr4Pt12
16
194
261.05
mp-1184811
-6.24603
-5.717903
3.509074
other
In2Ga6
8
194
171.86
mp-1188051
-5.385789
-3.746242
3.172801
other
Zr6Bi2
8
194
184.17
mp-1006059
-5.811794
-6.803065
1.546501
other
Tl6Bi2
8
194
255.79
mp-30726
-8.003949
-8.151647
2.984936
other
Y2Hg6
8
194
187.99
mp-976080
-4.845428
-5.033336
2.977361
other
Ge6B2
8
194
129.45
mp-1186776
-6.363028
-7.425854
2.847985
other
Sr2Tl6
8
194
243.54
mp-1191559
-7.843175
-2.338794
3.5799
other
Nb6Rh18
24
194
350.33
mp-1101860
-6.043546
-1.326324
4.269265
other
Sc4Tc8
12
194
205.01
mp-1185479
-7.638183
-6.58873
6.829051
other
Lu6Sc2
8
194
225.15
mp-1187308
-6.973909
-6.835575
7.141866
other
Tb6Pm2
8
194
270.43
mp-972889
-7.209886
-5.691086
3.160665
other
Sc2Sn6
8
194
201.06