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-1191783
-7.517512
0.915038
4.817575
other
Sm2Ga2Fe15C3
22
166
278.74
mp-756405
7.400337
14.09477
-1.051791
other
Li4Fe3Co1O8
16
166
146.36
mp-764098
7.810329
12.865519
-1.257614
other
Li2Ni3Te1O8
14
166
149.94
mp-14374
6.370581
4.888837
-4.474098
other
Na3Rh1N6O12
22
166
285.88
mp-1222843
12.228292
10.732409
0.572093
other
La1Tb3Mo4O14
22
166
292.02
mp-1215777
9.229937
13.599834
-0.797565
other
Zn2Cr1Fe3O8
14
166
155.23
mp-551456
8.174674
8.87691
1.026539
other
Ba2Cu1Cl1O2
6
166
156.04
mp-755839
11.247244
13.830327
-0.542827
other
Li6V2Cr6O16
30
166
298.28
mp-2218295
8.587339
14.330778
-1.019392
other
Mg1Mn3Bi1O8
13
166
175.67
mp-861572
10.705744
1.133433
1.781507
other
Li4Mn8O4F12
28
166
361.93
mp-1219338
-7.707423
-0.632037
3.603719
other
Sc1Ga4Fe3Co8
16
166
193.79
mp-12509
11.472777
8.180865
2.770914
other
Y2Zn2P2O2
8
166
134.4
mp-2228613
12.059514
8.683159
-0.330042
other
Mg1Ga4Cu2O8
15
166
159.89
mp-754722
12.430607
12.340397
0.896186
other
Li4Ti3Mn1O8
16
166
153.18
mp-756554
8.935221
12.721699
-0.75966
other
Li4Cu3Te1O8
16
166
156.46
mp-1103291
6.96564
5.475218
-4.856041
other
Cu2S2N2O6
12
166
206.11
mp-1246882
-5.144143
-0.499915
-5.828151
other
Mg2Cr3In1S8
14
166
280.13
mp-1222067
-7.402203
-0.903114
3.086392
other
Mn4Cr1Co10Ge5
20
166
235.31
mp-755163
8.136456
13.752836
-0.913407
other
Li6Ti2Fe6O16
30
166
304.86
mp-754080
12.268355
13.327834
-1.035064
other
Li1V3Zn2O8
14
166
150.45
mp-773363
10.812243
13.091424
-0.311815
other
Li8Mn6W2O16
32
166
335.49
mp-756669
12.595738
12.070544
1.029146
other
Li4Ti3Cr1O8
16
166
148.05
mp-9059
10.108902
11.778684
0.797391
other
K1Li6Ta1O6
14
166
145.56
mp-1247198
-5.025972
-0.509521
-5.758781
other
Mg2Sc1Cr3S8
14
166
276.32
mp-1077381
1.8724
2.164009
1.214088
other
Eu2B1Br1N2
6
166
127.24
mp-1225089
-7.324786
-0.549723
3.354316
other
Ga1Fe2Co4Si1
8
166
91.47
mp-1247222
-4.835441
0.05962
-5.324462
other
Y1Mg2W3S8
14
166
295.22
mp-1247036
-4.481532
-0.19523
-5.213256
other
Mg2Ti3Cr1S8
14
166
276.46
mp-1213913
10.035992
9.463046
1.665754
other
Ca1Y4Sb3O14
22
166
299.88
mp-2240859
-5.547738
-0.312923
-5.906357
other
Mg1Cr4Cu2S8
15
166
253.99
mp-754303
6.7007
13.568587
-1.379857
other
Li2Mn1Fe3O8
14
166
138.01
mp-755560
11.882019
13.743322
-1.253394
other
Li2Mn1V3O8
14
166
147.82
mp-1247028
-5.031934
-0.191189
-5.259335
other
Mg2Mn1V3S8
14
166
270.15
mp-1095623
8.630422
1.687705
-0.193012
other
Al1Hg3O2F6
12
166
167.05
mp-2228574
6.993169
10.578084
0.690958
other
Ba3Mg1Mn2O8
14
166
224.98
mp-1177536
8.649319
12.828498
-0.895367
other
Li3Ni3Te1O8
15
166
153.62
mp-1247085
-2.922513
-2.381268
-5.737953
other
Dy3Mg2Mo1S8
14
166
332.47
mp-1246327
-4.35365
-0.39629
-5.076718
other
Mg2Ti3Mn1S8
14
166
278.5
mp-1221865
-8.139482
-3.882164
1.846655
other
Mn2In1Sb1Pd4
8
166
133.77
mp-1189324
7.300617
7.939907
-3.879791
other
Fe3Pb1S2O14
20
166
251.71
mp-753919
6.406605
15.370403
-1.552219
other
Li4Co3Cu1O8
16
166
144.14
mp-549728
11.436522
8.168816
2.843288
other
Dy2Zn2P2O2
8
166
133.4
mp-867537
6.874546
14.566636
-1.496238
other
Li4Co3Ni1O8
16
166
133.78
mp-753531
12.05525
13.177146
0.946149
other
Li4Ti12V4O32
52
166
627.74
mp-779166
6.102313
13.550067
-2.1032
other
Li2Co6Ni2O16
26
166
258.04
mp-1235076
11.446567
12.521851
0.060391
other
Li1Cr4Hg2O8
15
166
180.22
mp-764983
11.258746
13.768446
-0.533647
other
Li6V2Cr6O16
30
166
297.22
mp-1173904
6.528955
18.772423
-0.850341
other
Li4Mn2Co2O8
16
166
148.46
mp-619611
11.363156
11.102117
0.172571
other
Ca2Fe1W1O6
10
166
124.99
mp-1174310
3.162344
21.930086
-1.700604
other
Li5Mn1Co2O8
16
166
148.01
mp-1227768
13.278905
5.606522
-5.799124
other
Ba1Sr2P2O8
13
166
180.64
mp-1221942
9.898041
9.880781
-0.112786
other
Mn2Bi3Sb3O14
22
166
296.42
mp-756871
9.330544
12.656682
-0.562773
other
Li4Ni3Te1O8
16
166
153.2
mp-1247217
-4.589561
0.08223
-4.886821
other
Y1Mg2Mo3S8
14
166
303.63
mp-1180836
5.843864
10.180242
-2.324679
other
K1Cr2Fe3O14
20
166
270.07
mp-757136
7.086526
14.099281
-1.709263
other
Li2Co3Sn1O8
14
166
142.28
mp-769856
7.259287
13.83742
-0.984923
other
Li4Fe3Ni1O8
16
166
148.45
mp-754228
8.542208
13.051553
-0.716004
other
Li4Ni3Sb1O8
16
166
151.47
mp-752999
6.139925
13.533163
-2.238235
other
Li1Fe1Co3O8
13
166
140.09
mp-1247084
-5.261212
0.380579
-5.347062
other
Mg2Ni1W3S8
14
166
259.23
mp-1246845
-5.29471
-0.588301
-4.70871
other
Mg2Ti1Co3S8
14
166
246.79
mp-556632
6.656422
11.648227
1.569251
other
Ba4Pr1Mn3O12
20
166
302.59
mp-1219692
8.184537
10.892564
0.641684
other
Pr1Bi3Ru4O14
22
166
282.83
mp-756660
12.887312
11.119067
1.479614
other
Li4Ti3Nb1O8
16
166
150.68
mp-1228074
7.266153
11.193128
1.245341
other
Ba3Mn2Ir1O9
15
166
217.06
mp-1226357
9.355223
0.795436
1.025685
other
Cs2Li1Cr3F12
18
166
287.93
mp-1222628
6.58118
16.076586
-1.351931
other
Li5Al1Co4O10
20
166
176.52
mp-1247202
-5.197978
-0.616152
-5.39442
other
Mg2Mn3W1S8
14
166
277.67
mp-1247146
-4.852371
0.209139
-5.026742
other
Mg2Cr1Mo3S8
14
166
286.77
mp-1246906
-4.446824
-0.314719
-4.978992
other
Mg2Ti3Co1S8
14
166
271.58
mp-1247200
-5.46253
-0.796107
-4.77662
other
Mg2Mn1Ni3S8
14
166
244.84
mp-753237
6.380428
13.858983
-1.957587
other
Li2Co3Ni1O8
14
166
128.25
mp-756409
10.481375
13.108648
1.084371
other
Li8Ti12Ni4O32
56
166
603.42
mp-6049
8.236983
10.535396
1.416976
other
Ba4Tb1Ru3O12
20
166
302.46
mp-1247119
-4.620997
-0.838415
-5.842966
other
Mg2Al3V1S8
14
166
269.6
mp-2646913
1.499717
2.685233
-5.911082
other
Cs8Mn2Sb4Cl24
38
166
1,270.89
mp-1246682
-4.660633
-0.727716
-5.752063
other
Mg2Al3Mo1S8
14
166
273.69
mp-1246565
-4.659388
0.174873
-4.953832
other
Mg2Ga1Mo3S8
14
166
288.8
mp-1246685
-5.129599
-0.623866
-4.862227
other
Mg2Ti1Fe3S8
14
166
247.48
mp-1247087
-5.381049
-0.604188
-4.695575
other
Mg2Ni3Mo1S8
14
166
255.31
mp-545506
11.354246
8.098666
2.796745
other
Gd2Zn2P2O2
8
166
137.05
mp-637030
-4.642275
-4.447192
6.142958
other
Gd2Al6Si4Pt1
13
166
255.13
mp-756625
8.1262
16.497375
-0.295432
other
Li4Mn3Fe1O8
16
166
148.69
mp-1216372
9.909218
13.586477
-0.832874
other
V1Fe3Cu4O8
16
166
188.83
mp-1227704
10.488987
11.819816
3.253352
other
Ca3Nb4O12F2
21
166
296.93
mp-1246841
-4.790762
0.182105
-4.808474
other
Mg2Ni1Mo3S8
14
166
277.07
mp-1247544
-5.383704
-0.091276
-5.791679
other
Mg2Cr3W1S8
14
166
273.66
mp-570771
-3.760501
-5.592706
5.224792
other
Ba1Li2Mg2Si2
7
166
158.48
mp-1174110
7.662412
17.727623
-0.375661
other
Li4Mn3Co1O8
16
166
150.15
mp-1177371
12.549273
13.058357
-0.413263
other
Li4V3Cr1O8
16
166
151.27
mp-8891
13.58641
4.615459
-1.837508
other
K2Zr1B2O6
11
166
148.56
mp-1235112
11.819796
8.829659
2.18232
other
Li1Dy2O2F2
7
166
85.44
mp-2227038
12.928223
8.212208
0.200143
other
Mg1Al4Cu2O8
15
166
145.1
mp-1247272
-3.015166
-2.433348
-5.869574
other
Y3Mg2Mn1S8
14
166
331.35
mp-757214
7.087105
14.362938
-1.527947
other
Li3Ti1Co3O8
15
166
135.9
mp-1191482
-7.617063
0.755671
4.431952
other
Ce2Fe12Co5N3
22
166
270.03
mp-1246931
-2.933619
-2.463141
-5.845535
other
Lu3Mg2V1S8
14
166
316.73
mp-1218534
9.70049
10.799035
3.5756
other
Sr5Zr1Ti4O15
25
166
318.89
mp-2219747
8.167305
14.465849
-1.305709
other
Mg1Mn3Co1O8
13
166
148.54
mp-2223690
10.230146
10.988093
0.011566
other
Mg1Tl2Fe2O4
9
166
162.17