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-1218184
10.173344
8.639969
2.742619
other
Sr1La1Al1O4
7
107
90.86
mp-2222855
11.049973
9.133804
2.106352
other
Pr2Mg1Cu1O4
8
107
121.75
mp-1217766
7.014486
11.067038
1.431846
other
Sr1Y1Co1O4
7
107
87.92
mp-1216974
10.236216
9.832121
0.538271
other
Ti1Nb1Bi3O9
14
107
198.79
mp-1227444
9.513225
8.223761
-0.799943
other
Bi1Pb1Br1O2
5
107
106.07
mp-1219447
10.695001
8.841289
-1.048968
other
Sb1Pb1I1O2
5
107
109.4
mp-1218235
7.124594
11.000773
1.287824
other
Sr1Gd1Ni1O4
7
107
88.88
mp-1225911
-7.576762
-4.591555
5.580224
other
La5Al15Cu2Au3
25
107
515.34
mp-1218142
9.722079
8.500525
3.264503
other
Sr1La1Sc1O4
7
107
104.46
mp-1227238
9.480988
8.151792
-0.384977
other
Ca1Bi1I1O2
5
107
110.66
mp-1222801
8.772971
9.665273
2.303227
other
La1Nd1Cu1O4
7
107
93.72
mp-1227067
9.817223
10.786153
2.116469
other
Ca1Nd1Cr1O4
7
107
90.42
mp-1236192
11.704082
8.787148
2.348888
other
Li1Pu2Te1O2
6
107
109.78
mp-1025275
11.41512
8.917051
2.447738
other
Ce2Al1N1O3
7
107
87.17
mp-1218285
7.831817
8.454626
0.915661
other
Sr1Eu1Sc1O4
7
107
103.19
mp-1223108
11.31838
7.946132
-4.140422
other
Li2U8As6O40
56
109
918.91
mp-669555
6.495815
4.763485
-4.454814
other
K4C4N12O24
44
109
706.86
mp-1205224
8.617323
1.308918
-4.222506
other
Ge8H80Se24N32
144
110
1,848.68
mp-1274114
6.915965
10.918126
1.362889
other
Sr4La4Co4O16
28
110
379.81
mp-1194563
11.547724
12.328298
-2.978784
other
Sr4Mn8V8O32
52
110
705.62
mp-1274989
8.258121
10.900573
2.231478
other
Sr12Ta4Co4O28
48
110
673.11
mp-1294077
7.018067
11.059708
1.425275
other
Sr4Y4Co4O16
28
110
356.22
mp-707540
13.195
5.545244
-6.357202
other
Zr4P8H8O32
52
110
721.9
mp-1284693
8.014396
10.777315
2.118419
other
Sr12Nb4Co4O28
48
110
680.29
mp-1203643
10.573013
11.848788
-3.48317
other
V8Co8Pb4O32
52
110
677.56
mp-1197716
12.57517
6.414779
-0.968165
other
Ba8Cu8Si16O48
80
110
1,159.43
mp-1207918
10.53796
11.807531
-3.335682
other
V8Ni8Pb4O32
52
110
654.81
mp-541734
10.530452
11.997041
-3.443409
other
Sr4V8Ni8O32
52
110
645.1
mp-1195702
10.697446
12.039931
-3.52214
other
Sr4V8Co8O32
52
110
659.7
mp-2217227
-5.141846
-0.907427
-5.566017
other
Mg1Fe2Cu2S4
9
111
148.14
mp-2223679
-4.505744
-1.229015
-5.68517
other
Mg1Nb1Cu3S4
9
111
186.35
mp-699554
7.085815
11.960898
1.962016
other
Sr6La6Mn12O36
60
111
714.15
mp-2217390
-4.649592
-1.410426
-5.583162
other
Mg1Cu3As1S4
9
111
172.52
mp-2227108
-4.584895
-0.642208
-5.458921
other
Mg1Cu2W1S4
8
111
185.06
mp-2226887
-4.61293
-0.626466
-5.451754
other
Mg1Cu2W1S4
8
111
167.83
mp-1220816
-4.546494
-1.125859
-5.545017
other
Nb2V3Cu15S20
40
111
811.02
mp-1190102
5.383547
-0.467436
-3.014
other
Li1Y1B4H16
22
111
249.71
mp-1222874
10.613588
8.685016
2.50751
other
La1Pr3Al4O12
20
111
219.64
mp-2222913
-4.653253
-1.136639
-5.670618
other
Mg1V1Cu3S4
9
111
174.84
mp-628568
-4.856399
-1.038496
-5.760779
other
Fe1Cu2Sn1S4
8
111
160.92
mp-2217276
-5.057761
-0.969949
-5.57162
other
Mg1Fe2Cu2S4
9
111
150.02
mp-1221388
5.16792
-0.305308
-2.702572
other
Na2B1H4N1
8
111
103.7
mp-1220497
-5.339938
-2.609862
-3.936347
other
Nb1V1Cu6Se8
16
111
360.43
mp-1194609
5.378874
-0.469417
-3.007389
other
Li2Y2B8H32
44
112
458.51
mp-1208694
-5.078892
-2.438724
-3.971704
other
Ta2In2Cu4Se8
16
112
413.67
mp-850195
14.235607
7.115199
-6.813073
other
Li8Mn4P8O28
48
113
628.55
mp-555560
11.164677
9.757593
-2.991049
other
Cd2Te2Mo2O12
18
113
268.65
mp-1209039
11.401103
7.505504
1.173215
other
Sm4Be2Ga4O14
24
113
306.64
mp-696666
9.428637
3.044668
-4.313025
other
H8N2Cl2O4
16
113
159.22
mp-734395
6.627864
6.497671
-3.792594
other
Cu2N12Cl6O24
44
113
680.46
mp-1212878
12.285702
6.779335
0.173211
other
Er4Be4Si2O14
24
113
252.39
mp-1210829
12.296974
6.728029
0.108854
other
Lu4Be4Si2O14
24
113
247.53
mp-756993
13.09201
7.478657
-7.241566
other
Li4Co2P4O14
24
113
297.6
mp-677780
12.687808
6.4316
-0.254354
other
Ca4Mg2Si4O14
24
113
298.62
mp-1207637
8.198195
8.069949
-2.62112
other
Yb4Be4Ge2O14
24
113
272.91
mp-14415
11.996338
6.920016
0.280715
other
Pr4Be4Ge2O14
24
113
291.86
mp-6208
12.678409
6.438811
-0.5033
other
Ca4Be2Si4O14
24
113
282.59
mp-1208014
12.192739
6.813864
0.172772
other
Tm4Be4Ge2O14
24
113
260.25
mp-15748
12.477665
6.321514
-0.541716
other
Sr4Cu2Si4O14
24
113
344.24
mp-1211518
11.211038
7.590037
1.339346
other
La4Be2Ga4O14
24
113
323.75
mp-1208884
12.222084
6.748063
0.178892
other
Sm4Be4Si2O14
24
113
269.34
mp-18596
11.817356
7.329017
-0.511134
other
Ca4Zn2Ge4O14
24
113
340.04
mp-1210014
11.330381
7.561664
1.355357
other
Nd4Be2Ga4O14
24
113
314.37
mp-1214098
13.36974
7.630684
-0.480343
other
Ca4Al2Si4O14
24
113
308.61
mp-17392
11.773374
7.322559
-0.33191
other
Sr4Zn2Ge4O14
24
113
368.29
mp-557826
12.064188
7.254694
-5.072104
other
Li6U14P10O70
100
113
1,494.29
mp-9338
12.273528
6.43241
-0.159679
other
Ba4Mg2Si4O14
24
113
366.42
mp-1202070
9.54407
5.191053
-6.853492
other
Er4Nb4S14O60
82
113
1,163.89
mp-1199771
11.233191
4.204696
-7.842237
other
Ce4Nb4S14O60
82
113
1,203.37
mp-756604
14.472502
7.501063
-6.098881
other
Li8Fe4P8O28
48
113
623.33
mp-18251
11.117121
12.233469
-3.306767
other
K4Mn2V4O14
24
113
435.68
mp-1209882
12.030095
6.878723
0.281357
other
Nd4Be4Ge2O14
24
113
287
mp-20778
12.145514
6.817852
0.162694
other
Dy4Be4Ge2O14
24
113
267.66
mp-14420
12.175094
6.842961
0.221353
other
Er4Be4Ge2O14
24
113
263
mp-1191240
12.487542
6.410916
-0.221453
other
Sr4Zn2Si4O14
24
113
343.62
mp-1204935
9.41118
5.251357
-6.76888
other
Dy4Nb4S14O60
82
113
1,174.51
mp-559691
12.519922
6.761755
0.227589
other
Ca4Al4Si2O14
24
113
305.88
mp-1192147
12.189251
7.597126
-0.481262
other
Ba8Mn4Ge8O28
48
113
835.12
mp-19926
11.901752
6.962837
0.383504
other
La4Be4Ge2O14
24
113
292.24
mp-1013911
13.224968
6.918597
-6.723085
other
Na8Co4P8O28
48
113
637.92
mp-12240
8.963522
0.945273
1.447115
other
Na4Li2Be4F14
24
113
290.2
mp-7013
12.319613
6.685132
0.190153
other
Ho4Be4Si2O14
24
113
255.55
mp-557323
10.762424
12.247001
-3.591339
other
Na4V4Zn2O14
24
113
366.78
mp-1190662
13.283689
7.440209
-0.617196
other
Eu4Mn2Si4O14
24
113
352.75
mp-650715
12.016043
6.886756
0.148182
other
Gd4Be4Ge2O14
24
113
275.09
mp-1190935
12.795562
6.203279
-6.544014
other
K4Cu2P4O14
24
113
352.03
mp-752851
13.601001
4.891007
-1.903765
other
Ca4Si2B4O14
24
113
250.02
mp-1191511
13.622355
6.849827
-6.066213
other
K8Fe4P8O28
48
113
857.6
mp-982662
12.766892
6.909688
-0.114417
other
Eu4Mg2Si4O14
24
113
339.34
mp-22067
11.714471
7.287226
-0.574439
other
Ba4Cu2Ge4O14
24
113
408.12
mp-972387
11.789638
7.329875
-0.088796
other
Sr4Mg2Ge4O14
24
113
366.94
mp-1190949
11.668884
7.306759
-0.27754
other
Ba4Zn2Ge4O14
24
113
406.2
mp-6941
2.869665
2.440288
1.87549
other
Y4Si6N8O6
24
113
289.59
mp-1212449
12.169845
6.714016
0.11437
other
Gd4Be4Si2O14
24
113
265.38
mp-1191317
12.035773
7.402236
-0.668766
other
Sr4Co2Ge4O14
24
113
368.27
mp-1191740
13.15688
7.092889
-0.551396
other
Sr4Mn2Si4O14
24
113
353.95
mp-1220055
5.411865
4.471468
-3.913059
other
Pd2N8Cl4O2
16
113
250.82
mp-1190545
11.673462
7.338904
-0.082456
other
Ba4Mg2Ge4O14
24
113
394.72
mp-1202258
9.782129
4.945383
-7.00212
other
Nd4Nb4S14O60
82
113
1,233.5
mp-6227
12.577717
6.424795
-0.431333
other
Ca4Zn2Si4O14
24
113
316.25