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-23507
-0.506794
1.152503
-4.432882
other
In2Sn4Br10
16
140
515.48
mp-3868
-7.774726
0.34056
5.664732
other
Pr12Fe26Ag2
40
140
765.06
mp-1105558
-6.088364
-7.159888
3.832578
other
Ca10Cd2Cu4
16
140
459.97
mp-1105736
6.70833
6.473798
-3.890807
other
Be2S2O16
20
140
279.02
mp-1197173
-7.721449
0.265327
5.65954
other
Pr12Fe26Sn2
40
140
774.19
mp-1188465
-0.417373
1.463745
-4.845439
other
Cs6Cd2Br10
18
140
744.89
mp-1188851
-8.298755
-6.552597
5.910551
other
Ho10Bi2Au4
16
140
422.77
mp-1213902
-7.104601
-5.206575
5.152545
other
Ce10Ge4Pd2
16
140
399.38
mp-1238789
-1.136432
2.725904
-2.944011
other
Cs2Pb4I10
16
140
712.21
mp-10166
-4.765445
-3.093758
-3.966619
other
Na2Al2Se4
8
140
184.24
mp-27334
1.404852
2.371038
-5.489686
other
Tl6Fe2Cl10
18
140
511.06
mp-1218007
-5.548485
-2.110595
3.670092
other
Ta10Ge4B2
16
140
255.2
mp-569081
-7.779155
-6.435953
6.198352
other
Tb10Sb2Au4
16
140
479.67
mp-1104946
-8.156989
-2.532711
2.527799
other
Pr2Ni8Sn4
14
140
233.01
mp-1206863
1.180293
2.37617
-5.932791
other
Cs2Ca2Cl6
10
140
317.04
mp-23539
1.336546
2.41149
-5.496803
other
K2Sn4Cl10
16
140
453.74
mp-1407767
9.084974
2.290451
1.838248
other
Ca2Ti2F8
12
140
166.2
mp-1207805
-6.052641
-1.017523
3.502708
other
V2Si6Mo8
16
140
222.52
mp-17230
-5.705934
-2.874214
3.338767
other
Nb10Ga2Sn4
16
140
296.32
mp-18127
-8.015373
-2.54139
2.572983
other
Sr2Ni8Sn4
14
140
237.44
mp-561920
8.323719
0.511198
0.323327
other
Cs2Ag2F6
10
140
174.82
mp-1200065
-8.574672
-0.589129
4.874262
other
La12Co26Bi2
40
140
765.34
mp-1214514
-7.097661
-5.707893
4.592523
other
Ce24Sn10Ge6
40
140
1,132.71
mp-567883
-5.170855
-2.984753
2.78694
other
Ti8Co2Bi4
14
140
270.63
mp-1202920
-7.795807
0.295403
5.649595
other
Nd12Ga2Fe26
40
140
783.94
mp-643895
3.152997
-0.580495
-2.509784
other
Cs6Mg2H10
18
140
442.97
mp-22483
-6.101117
-3.467541
-2.079293
other
Na2In2Te4
8
140
254.29
mp-1181094
2.547504
-0.852977
-1.837343
other
Hf4Si2H2
8
140
114
mp-11144
-8.955498
-4.640878
3.589003
other
Sr2Cu18Ge8
28
140
413.37
mp-30164
1.391516
2.553138
-5.648824
other
Cs2Sn4Cl10
16
140
510.76
mp-1188522
-5.167285
-4.49803
6.196151
other
Pr10Si4Ge2
16
140
439.62
mp-27333
1.532758
2.498456
-5.508297
other
Tl6Co2Cl10
18
140
508.49
mp-1212486
-5.536974
-3.673537
3.261828
other
Hf10Fe2Sb4
16
140
331.75
mp-19197
9.829852
9.956333
1.626761
other
Ba6Cr2O10
18
140
315.88
mp-1187247
12.20888
10.639223
0.435521
other
Sr2Mo2O6
10
140
134.51
mp-569743
-5.335909
-2.833627
2.99794
other
Ti8Mn2Bi4
14
140
281.32
mp-1193206
-8.075848
-1.90826
2.700883
other
Ce2Ni18Ge8
28
140
369.13
mp-569118
-1.189732
3.066015
-2.942761
original
Cs6Mn2I10
18
140
881.67
mp-643245
3.337447
-0.591227
-2.346252
other
K6Mn2H10
18
140
340.78
mp-1209713
-7.431002
-6.502426
6.358623
other
Pr10Fe4Sb2
16
140
445.46
mp-866830
-3.302531
-1.847688
-5.629281
other
Ca6Sn2S10
18
140
422.23
mp-752768
8.629564
1.05847
-0.414136
other
Li2Ag2F8
12
140
150.44
mp-568686
-7.945467
-6.413263
6.0015
other
Er10Bi2Au4
16
140
474.38
mp-1198335
-7.767489
0.268226
5.681311
other
Nd12Fe26Ge2
40
140
743.02
mp-17652
-7.28993
-6.096716
6.474874
other
Tb24Al12Si4
40
140
1,036.17
mp-23467
-0.529018
1.158037
-4.550948
other
Cs2Sn4Br10
16
140
576.86
mp-11726
-7.78632
-1.718494
2.864624
other
La2Si8Ni18
28
140
351.98
mp-1208257
-5.432021
-2.798054
3.243371
other
Ti8Cr2Bi4
14
140
281.85
mp-1213250
-8.107388
-6.023344
5.651119
other
Er10Sb2Pd4
16
140
393.91
mp-5076
10.170205
9.693503
4.033655
other
Sr2Zr2O6
10
140
139.29
mp-570187
-7.698884
-6.523331
6.277902
other
Tb10Bi2Au4
16
140
490.65
mp-605809
-5.220026
-7.015375
3.074614
other
Ba22In12O6
40
140
1,364.17
mp-22706
-6.031547
-0.205195
3.32814
other
Mn6Ge2C2
10
140
112.4
mp-1209930
-5.31604
-1.914304
3.328199
other
Nb10Si2B4
16
140
229.61
mp-10165
-6.051568
-3.494793
-2.016167
other
K2Al2Te4
8
140
263.02
mp-30278
-7.052414
-5.304585
5.281759
other
Ce6Ga8Cl2
16
140
365.17
mp-22791
-6.133908
-3.566741
-2.210939
other
Tl2In2Te4
8
140
273.33
mp-1197673
-8.605066
-0.528886
4.922114
other
La12Co26Pb2
40
140
753.48
mp-28577
8.130877
2.028462
-0.96329
other
Rb2Br2F8
12
140
284.54
mp-984872
1.411109
2.430816
-5.498968
other
Cs2Pb4Cl10
16
140
498.73
mp-21297
-7.701381
-4.876609
2.657968
other
Li2Sn8Ru2
12
140
248.92
mp-1208418
-8.183685
-6.20647
6.194112
other
Tb10Bi2Pt4
16
140
422.02
mp-1214527
-5.949305
-6.757827
2.551076
other
Ba6Sn8Bi2
16
140
590.3
mp-1197167
-7.820978
0.336222
5.644445
other
Nd12Fe26Ag2
40
140
752.24
mp-567961
-7.775139
-6.58745
6.325399
other
Dy10Bi2Au4
16
140
485.09
mp-1212213
-8.316565
-6.204677
6.066811
other
Ho10Bi2Pt4
16
140
410.26
mp-1209380
1.28517
2.464451
-5.622106
other
Rb6Fe2Cl10
18
140
551.59
mp-4984
-5.838574
-0.18928
3.251156
other
Si2B4Mo10
16
140
204.45
mp-1213407
-8.2815
-1.903117
2.762442
other
Eu2Ni18Ge8
28
140
401.2
mp-1213041
-4.718476
-3.399218
-3.93326
other
Ga4Bi4S4
12
140
491.9
mp-9537
-7.69109
0.281364
5.669779
other
Pr12Fe26Si2
40
140
750.41
mp-12633
-6.10939
-0.039208
3.147381
other
Mn10B4P2
16
140
158.88
mp-1193573
-8.105304
-1.86216
2.663531
other
Eu2Ni18Ge8
28
140
379.11
mp-568497
-8.944992
-4.979302
3.228327
other
Eu2Cu18Sn8
28
140
468.48
mp-1096790
0.068844
1.44179
-4.169866
other
Cu2Pb2Br6
10
140
364.99
mp-35138
-5.867249
-3.988252
-2.099283
other
Tl8Te6Mo2
16
140
498.85
mp-1207984
-7.821634
-6.292062
6.120282
other
Tm10Ni4Sb2
16
140
367.65
mp-23417
-1.257511
2.639777
-3.002937
other
In2Sn4I10
16
140
623.03
mp-1196326
-7.789968
0.365767
5.654005
other
Sm12Fe26Sn2
40
140
749.51
mp-1192662
-8.932507
-4.986785
3.232907
other
Sr2Cu18Sn8
28
140
475.81
mp-1214495
9.56996
9.369978
2.63807
other
Ba6Ti2O10
18
140
322.91
mp-24083
2.885458
-0.391863
-1.771991
other
Th4Al2H8
14
140
189.93
mp-1208246
-5.254247
-2.83991
2.692824
other
Ti10Co2Sb4
16
140
277.67
mp-1200485
-7.717955
0.319484
5.555002
other
Nd12Fe26As2
40
140
736.95
mp-1202553
-7.687297
0.188263
5.614351
other
Nd12Fe26Bi2
40
140
765.6
mp-1202421
-7.804875
0.292586
5.696745
other
Nd12Cd2Fe26
40
140
745.47
mp-1078396
-3.89064
-2.449475
-3.745405
other
In2Se4N2
8
140
183.8
mp-1212904
-8.027614
-6.589164
6.476257
other
Dy10Co4Bi2
16
140
394.19
mp-505764
-5.962965
-2.003516
3.680395
other
Nb18Co8Ge2
28
140
441.47
mp-23541
-0.505092
1.133863
-4.424706
other
K2Sn4Br10
16
140
521.64
mp-1208413
-7.919498
-6.223889
6.103437
other
Tb10Sb2Pd4
16
140
416.78
mp-1398106
9.403722
1.096374
1.324047
other
Ca2Mn2F8
12
140
161.05
mp-1209957
-4.543522
-3.170882
-3.950498
other
Na2Tl2Se4
8
140
218.02
mp-21834
-7.785836
0.253574
5.652447
other
Nd12Fe26Sn2
40
140
764.92
mp-1105372
-7.016824
0.599068
3.474545
other
Fe10Si2B4
16
140
156.02
mp-24668
8.673047
0.939322
0.639216
other
Cs2H2F4
8
140
145.3
mp-1199952
-7.788622
0.254531
5.670541
other
Nd12In2Fe26
40
140
773.73
mp-574507
-3.224448
-8.176994
1.559608
other
Eu2Cu8Sn4
14
140
424.57
mp-1203126
-7.869545
0.358675
5.584846
other
Nd12Fe26Au2
40
140
744.07
mp-1196648
-7.792355
0.328251
5.678012
other
Nd12Zn2Fe26
40
140
737.78