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-756291
13.356362
8.817408
-1.575268
other
Li2V4Si4O16
26
17
266.84
mp-1239176
-5.487106
-0.188238
-5.704751
other
Ta2Cr6Cu4S16
28
17
493.7
mp-1239167
-5.488416
-0.193822
-5.717894
other
Ta2Cr6Cu4S16
28
17
496.91
mp-755273
10.095855
2.458341
2.20948
other
Li4Fe8O4F12
28
17
332.16
mp-1239190
-5.353735
-0.139964
-5.697577
other
Ta2Cr6Ag4S16
28
17
546.57
mp-557047
8.727755
0.562516
1.197361
other
Cs4Na2Cr2F12
20
166
361.61
mp-1235478
10.646273
6.054298
2.074287
other
Li1Dy2O2F2
7
166
92.49
mp-567643
-4.60702
-7.099352
2.908908
other
Ba12Na15Li8N6
41
166
1,459.9
mp-1217164
-4.604758
-0.354595
-4.870216
other
Ti3Co1Cu2S8
14
166
242.85
mp-6163
8.515277
0.640121
1.335897
other
Cs4Na2Ga2F12
20
166
358.44
mp-758629
6.695617
13.919355
-2.156843
other
Li2Cr2Co6O16
26
166
282.22
mp-850200
9.906337
14.04434
-0.633081
other
Li3Cr3Fe1O8
15
166
147.02
mp-1222068
-6.939454
-0.266887
3.509136
other
Mn2Fe4Si1Ge1
8
166
90.26
mp-1247102
-5.443214
-0.448876
-5.5599
other
Mg2Cr3Ni1S8
14
166
260.91
mp-2228638
11.902447
11.02191
-2.104992
other
Na4Mg1Mo2O8
15
166
210.32
mp-1220266
10.36049
9.366431
3.79241
other
Nd3Ho1Zr4O14
22
166
308.69
mp-1235517
12.911073
12.323249
-0.341652
other
Li1Mn2V4O8
15
166
169.33
mp-755986
11.302936
13.197844
0.083864
other
Li4Nb2Cr6O16
28
166
310.74
mp-2227113
7.527152
12.567275
-1.097643
other
Mg1Zn2Ni4O8
15
166
154.05
mp-1219094
8.13098
10.976822
0.609277
other
Sm1Bi3Ru4O14
22
166
280.52
mp-510549
6.532204
0.416517
-3.503034
other
K3B12H12Br1
28
166
333.66
mp-6504
8.635068
3.680576
-7.092385
other
Ba1Mg1C2O6
10
166
126.78
mp-1224076
-3.914492
-1.291961
-5.839677
other
In4Ag2S6Cl2
14
166
337.36
mp-12017
-7.03462
-4.835104
5.14122
other
Ce1Al4Ge2Au1
8
166
165.2
mp-759061
9.584189
14.25355
-0.854317
other
Li6Cr6Co2O16
30
166
291.55
mp-755971
9.281075
14.106787
-0.846691
other
Li2Mn3Te1O8
14
166
166.19
mp-753893
6.257708
13.77841
-1.691367
other
Li3Fe1Co3O8
15
166
147.79
mp-1174405
3.648454
23.193724
-1.348427
other
Li6Mn2Co2O10
20
166
183.73
mp-772714
12.042653
13.364484
-0.64219
other
Li4V3Ni1O8
16
166
142.51
mp-756390
7.525984
13.493716
-0.961426
other
Li3Mn1Cu3O8
15
166
145.31
mp-758547
9.345379
13.170948
-0.887236
other
Li2Fe3Te1O8
14
166
161.74
mp-560597
12.961597
5.994749
-1.338334
other
Na8Si6Sn1O18
33
166
411.43
mp-756407
9.489616
13.234181
-0.598402
other
Li3Fe3Sb1O8
15
166
160.62
mp-1247001
-5.438403
-0.530858
-4.679327
other
Mg2V1Co3S8
14
166
245.1
mp-2227072
12.448008
11.383658
1.750744
other
Mg1Ti3Zn2O8
14
166
165.88
mp-756107
8.402011
13.471967
-0.990638
other
Li4Fe6Sb2O16
28
166
318.84
mp-1106088
8.906736
0.574019
0.535508
other
Cs2Cu3Sn1F12
18
166
315.04
mp-1246683
-5.30636
-0.771288
-5.248153
other
Mg2Mn3Ni1S8
14
166
263.34
mp-774694
6.350043
13.22432
-1.403175
other
Li2Ni3Sn1O8
14
166
145.77
mp-1226326
-5.535357
-0.393147
-5.852837
other
Cr3Cu2Sb1S8
14
166
255.66
mp-1220211
10.33857
9.653254
3.681147
other
Nd4Zr3Ti1O14
22
166
306.02
mp-754294
7.305996
13.880847
-1.729215
other
Li2V1Co3O8
14
166
133.48
mp-1247245
-4.59965
-0.25903
-5.348072
other
Dy1Mg2V3S8
14
166
287.92
mp-1246382
-4.860309
-0.956865
-5.461046
other
Y1Mg2Mn3S8
14
166
292.38
mp-1246786
-4.999937
-0.577202
-5.807672
other
Dy1Mg2Cr3S8
14
166
286.39
mp-1247237
-4.43017
-0.854177
-5.564587
other
Mg2In3W1S8
14
166
302.92
mp-1177849
10.516299
13.881264
-0.470234
other
Li2Ti1Cr3O8
14
166
148.29
mp-768828
9.661016
14.185255
-0.781014
other
Li3Cr3Cu1O8
15
166
144.52
mp-1283831
7.419909
11.014247
1.547283
other
Sr8Ta4Co4O24
40
166
496.52
mp-24796
6.589891
0.404097
-3.527952
other
Rb3B12H12Br1
28
166
361.24
mp-2218499
7.01752
10.641038
-1.440557
other
Mg1Cu4Cl2O6
13
166
159.1
mp-2218822
6.334544
13.36919
-2.126321
other
Mg1Co3Ni1O8
13
166
140.63
mp-1219861
8.257824
11.020315
0.949808
other
Pr3Bi1Ru4O14
22
166
287.05
mp-972937
11.151022
8.733946
3.1076
other
Sc2Al2C2O2
8
166
93.16
mp-1179134
7.422371
8.308996
-3.009705
other
Sr1Al3P2O14
20
166
242.36
mp-1247023
-5.161778
-0.65573
-5.331267
other
Mg2Mn3V1S8
14
166
271.24
mp-1177911
9.010147
14.490963
-0.691536
other
Li4Mn6Sb2O16
28
166
320.89
mp-1247050
-2.872029
-2.499668
-5.839354
other
Sm3Mg2V1S8
14
166
342.44
mp-757175
12.244589
13.537761
-0.918232
other
Li3Mn1V3O8
15
166
151.19
mp-1247249
-2.92557
-2.463461
-5.949828
other
Dy3Mg2Cr1S8
14
166
327.63
mp-1221808
-7.466387
-1.387822
2.870782
other
Mn4Cr1Co10Sn5
20
166
268.63
mp-556877
8.060174
10.520263
1.289495
other
Ba7Ru4Br2O15
28
166
536.67
mp-1221946
12.521881
12.738257
-0.879361
other
Mn2V3Ni1O8
14
166
160.99
mp-554143
8.104761
10.531009
1.334837
other
Ba7Ru4Cl2O15
28
166
522.46
mp-1247108
-4.802567
0.110947
-4.895949
other
Mg2Mn1Mo3S8
14
166
288.28
mp-1174206
3.598203
22.788649
-1.400101
other
Li6Mn2Co2O10
20
166
187.64
mp-768681
10.314771
13.812676
-0.529184
other
Li2Cr3Sn1O8
14
166
157.7
mp-1247027
-3.012801
-2.225258
-5.576286
other
Mg2Sc3Mo1S8
14
166
301.29
mp-1247221
-3.025825
-2.490335
-5.884265
other
Lu3Mg2Mn1S8
14
166
317.95
mp-1247276
-4.990775
-0.705093
-5.421206
other
Mg2Ti1Mn3S8
14
166
276.96
mp-753967
8.536543
14.971461
-0.786366
other
Li2Mn3Ga1O8
14
166
147.17
mp-1246787
-4.673489
-0.942919
-5.856069
other
Mg2Cr1Ga3S8
14
166
276.56
mp-1247396
-3.989621
-0.623938
-5.046109
other
Y1Mg2Ti3S8
14
166
296.1
mp-2232475
11.870574
10.88771
-1.304924
other
Na4Mg1W2O8
15
166
211.67
mp-1225853
-4.547406
-1.007779
-5.819286
other
Cu2Ni1Sn3S8
14
166
280
mp-1221327
7.303012
15.270872
-0.800958
other
Na2Mn1Ni1O4
8
166
86.74
mp-1181915
7.89443
8.257626
-3.379385
other
Ce1Al3P2O14
20
166
223.88
mp-773427
7.742314
17.773937
-0.315368
other
Li4Mn3Cu1O8
16
166
148.42
mp-1201833
7.013486
8.055186
-3.528877
other
Fe6Pb1S4O28
39
166
513.83
mp-1220276
8.151673
11.063462
0.945629
other
Nd3Bi1Ru4O14
22
166
285.51
mp-757126
9.550983
13.477987
-0.42584
other
Li3Nb1Fe3O8
15
166
159.19
mp-850338
11.667027
13.409337
-0.123045
other
Li8V2Cr6O16
32
166
298.61
mp-1215599
-5.346079
-2.017437
-3.928065
other
Zn2Cr3Ga1Se8
14
166
302.82
mp-761748
6.984929
14.161364
-1.811916
other
Li2Cr1Co3O8
14
166
134.44
mp-1218573
7.825114
11.687994
0.977263
other
Sr4Ca1Cr5O15
25
166
290.18
mp-1221928
-4.590709
-1.006531
-5.830377
other
Mn1Cu2Sn3S8
14
166
287.72
mp-1247148
-5.203312
-0.46142
-5.783098
other
Mg2Cr3Ga1S8
14
166
269.46
mp-1246406
-4.62311
0.277439
-4.828902
other
Mg2V1Mo3S8
14
166
287.16
mp-775286
5.842046
12.428028
-1.685154
other
Li2Fe3Ni1O8
14
166
138.81
mp-1228498
13.178406
5.667652
-5.671202
other
Ba2Sr1P2O8
13
166
191.75
mp-1173886
6.662403
18.615807
-0.814275
other
Li2Mn1Co1O4
8
166
73.99
mp-1217085
-7.823207
-1.989735
2.677082
other
Ti1Mn1Ni4Sn2
8
166
112.5
mp-1247341
-4.54691
-0.285336
-5.260438
other
La1Mg2V3S8
14
166
297.04
mp-1226867
-4.350096
-1.217145
-5.865214
other
Cd1Cu2Sn3S8
14
166
299.36
mp-756701
9.680266
13.805254
-0.480407
other
Li3Mn3W1O8
15
166
168.29
mp-771310
6.515177
13.810269
-1.404813
other
Li3Mn1Ni3O8
15
166
142.25
mp-1189579
7.506195
7.96647
-3.50619
other
Na1Al3S2O14
20
166
242.29
mp-756610
6.667918
13.395334
-1.17582
other
Li3Mg1Ni4O8
16
166
142.97
mp-774822
8.194569
14.734291
-1.252179
other
Li2Mn3Co1O8
14
166
142.61
mp-1215993
8.137792
11.039511
0.597584
other
Y1Bi3Ru4O14
22
166
278.31