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-762632
11.572966
7.30567
-2.202688
other
Li2Fe2Si2O8
14
148
179.24
mp-935266
7.360909
5.38749
-4.820623
other
Li1C2N1O6
10
148
88.83
mp-2217763
10.287894
9.51713
-0.444125
other
Mg1Ag2Sb2O6
11
148
163.53
mp-1225793
11.180544
10.195605
2.429684
other
La2Ti1Cr1O6
10
148
123.73
mp-1103164
6.945225
8.405007
-2.662614
other
Ca2Ga1Cl1O8
12
148
209.22
mp-570931
1.653691
2.146853
1.279801
other
Sr2Li6Mn2N6
16
148
190.47
mp-556129
7.613747
6.617707
-3.002975
other
Cs2Zr1I6O18
27
148
507.92
mp-1391671
6.405497
10.484842
0.531662
other
La2Mg1Ni1O6
10
148
116.1
mp-8271
13.730269
4.313173
-2.009805
other
Ba2Ca1B6O12
21
148
274.85
mp-23091
9.360445
9.220568
1.038263
other
Ba2Bi1Sb1O6
10
148
162.47
mp-761073
11.435343
7.360524
-7.353294
other
Na6Fe4P6O24
40
148
509.28
mp-568883
-2.332645
-3.438039
-5.001043
other
Pr18Si6Se12N18
54
148
1,110.02
mp-27003
14.558122
8.57795
-4.650503
other
Li6Mo4P6O24
40
148
496.37
mp-13056
9.518959
9.683827
3.433219
other
Ba2La1Ta1O6
10
148
165.92
mp-2217161
8.998488
3.431506
-7.648454
other
Mg1V1C2O6
10
148
99.74
mp-1222048
8.825799
3.616239
-7.264609
other
Mg1Fe1C2O6
10
148
99.5
mp-23092
9.787821
9.794579
2.849769
other
Ba2Ta1Bi1O6
10
148
162.41
mp-1093996
7.870898
2.448977
-4.590087
other
Zn6H6C24O18
54
148
1,346.94
mp-1222070
13.566113
5.966415
-7.469615
other
Mg1Ti4P6O24
35
148
452.54
mp-1104571
1.501891
1.965803
1.262899
other
Ba6Re2N6O1
15
148
341.66
mp-6122
9.11584
9.099994
2.29208
other
Ba2Nd1Sb1O6
10
148
162.76
mp-1227896
11.05339
7.532722
-3.776086
other
Cd30As18Cl4O74
126
148
1,807.19
mp-984716
12.984695
5.977334
-7.063601
other
Ca1Sn4P6O24
35
148
475.7
mp-14398
13.63434
4.82925
-2.419548
other
Ca1Sn1B2O6
10
148
114.19
mp-1227633
8.564329
11.563465
-0.749412
other
Be6Bi2Rh18O36
62
148
672.86
mp-1405776
9.97138
10.929472
1.785002
other
La2V1Zn1O6
10
148
124.15
mp-2217116
8.698655
3.64638
-7.242279
other
Mg1Mn1C2O6
10
148
101.98
mp-13356
9.492958
9.093673
0.357169
other
Ba2Sr1Te1O6
10
148
164.75
mp-1197664
12.282225
6.537334
-7.028921
other
K6Li6P12O38
62
148
878.15
mp-2217791
8.900145
14.046365
-0.436319
other
Mg1Mn2Zn2O6
11
148
122.49
mp-6031
1.950473
2.265105
1.452829
other
Li16Nb2N8O1
27
148
266.19
mp-1181708
4.090825
2.421954
-3.142393
other
K3Au3C6N6
18
148
575.2
mp-2217366
10.342813
9.502788
0.264611
other
K2Mg1Sb2O6
11
148
168.3
mp-2240405
8.564315
14.560445
-0.996527
other
Mg1Mn2Ag2O6
11
148
127.11
mp-19310
6.342822
4.965746
-4.504351
other
Na3Co1N6O12
22
148
274.3
mp-19078
9.953959
10.943749
1.225544
other
Ba2Sr1W1O6
10
148
166.34
mp-555866
8.847212
3.633644
-7.022507
other
K12Be8C12O38
70
148
1,031.3
mp-2217852
11.997152
10.426417
2.289729
other
Yb2Mg1Ti2O6
11
148
130.44
mp-2218083
12.264664
10.766779
1.928145
other
Mg1Ti2Cd2O6
11
148
135.66
mp-2230452
10.979616
8.866434
2.533253
other
Tm6Mg1W1O12
20
148
271.67
mp-758423
10.913222
7.579061
-2.640532
other
Li6Co6Si6O24
42
148
511.08
mp-2229986
10.989682
8.9158
2.52431
other
Lu6Mg1W1O12
20
148
266.34
mp-1223873
13.518432
4.574564
-1.355188
original
Ho1Sc1B2O6
10
148
111.17
mp-774821
12.049237
7.473617
-7.464675
other
Li4Ni4P4O16
28
148
332.38
mp-1385417
10.309862
10.582634
1.92015
other
Ca1La2V1O6
10
148
137.29
mp-2217929
6.843938
12.333694
-1.479379
other
Mg1Tl2Co2O6
11
148
143.46
mp-1233672
11.444686
13.250632
-2.330347
other
Mg1V4Cu3O12
20
148
199.28
mp-2217789
12.068879
8.24416
-0.878567
other
Mg1Al2Co2O6
11
148
107.07
mp-866313
13.366418
4.781069
-1.641707
other
Ba6In2B6O18
32
148
447.57
mp-1190588
13.772476
4.294348
-2.093053
other
Ba2Cd1B6O12
21
148
268.84
mp-19430
11.50891
7.738593
-7.796693
other
Li6Fe4P6O24
40
148
468.02
mp-2230361
11.396847
9.662191
2.563797
other
La4Mg1Ti3O12
20
148
255.27
mp-19406
7.74752
11.356287
2.134686
other
La8Mg4Mn4O24
40
148
481.91
mp-752664
12.510357
7.648972
-7.420811
other
Li2Co2P2O8
14
148
180.6
mp-1275611
7.629031
11.463078
2.14233
other
La8Mn4Zn4O24
40
148
488.64
mp-759020
12.10008
7.24394
-1.824665
other
Li6Fe6Si6O24
42
148
525.53
mp-1274023
6.302852
10.404316
0.49312
other
La2Zn1Fe1O6
10
148
123.7
mp-696189
7.432376
4.699315
-4.584965
other
Tl2H12N6O24
44
148
460.57
mp-1407332
11.247322
10.281262
1.494292
other
La2Zn1Mo1O6
10
148
132.46
mp-1195060
11.7434
4.830371
-5.552899
other
Mn6P12H24O24
66
148
1,065.07
mp-1216285
-5.63298
1.261936
-4.679313
other
Zn1Fe1Mo12S16
30
148
548.86
mp-19383
13.657478
6.386668
-7.399827
other
Ti4Mn1P6O24
35
148
443.19
mp-555477
9.014356
5.475265
-4.072667
other
Ag2H3I1O6
12
148
130.66
mp-11659
13.673925
4.643972
-2.085183
other
Ba1Ti1B2O6
10
148
125.01
mp-1104786
1.559106
1.934179
1.545746
original
Ca6Cr2H1N6
15
148
215.21
mp-2230025
11.372091
9.644843
0.123036
other
Mg1In6W1O12
20
148
264.65
mp-1180718
13.121313
5.740859
-7.121543
other
K2Sn4P6O24
36
148
497.41
mp-2230066
10.599749
8.979205
2.298574
other
La6Mg1W1O12
20
148
326.01
mp-569413
1.283
2.23856
-4.039256
other
K2Sr1Nb6Cl18
27
148
694.99
mp-1237522
12.059197
7.019333
-6.952604
other
Bi4Sb12P24O96
136
148
1,871.55
mp-1223020
-7.030783
1.503334
-4.181791
other
La1Mo12Pb1Se16
30
148
648.33
mp-1404626
11.6677
10.02834
1.207919
other
La2Mg1W1O6
10
148
131.39
mp-19021
12.652685
7.215974
-6.788916
other
Ba2Co4P4O16
26
148
331.29
mp-558428
11.953566
6.679548
0.25969
other
Ba9Sc2Si6O24
41
148
641.84
mp-2217653
10.430858
9.619042
0.170259
other
Na2Mg1Sb2O6
11
148
153.97
mp-729553
9.088668
7.387276
-4.646647
other
Rb6P6N6O12
30
148
561.41
mp-541299
14.160886
5.230651
-7.569464
other
Zr4Cd1P6O24
35
148
506.34
mp-1198871
9.000794
7.558931
-5.262096
other
Zn6P12H12O38
68
148
1,034.09
mp-569465
1.3072
2.347651
-4.214227
other
Cs2Nb6Pb1Cl18
27
148
728.23
mp-2217666
12.677856
11.278125
1.29688
other
Mg1Ti2Mn2O6
11
148
121.85
mp-1396276
9.546046
8.825258
2.429614
other
Ca1La2Sn1O6
10
148
148.8
mp-569879
1.427863
2.392637
-3.988042
other
Cs2Ta6Pb1Cl18
27
148
723.52
mp-1272167
7.753358
11.301753
2.209366
other
Ca4La8Mn4O24
40
148
540.72
mp-1182013
8.299704
2.954907
-5.167838
other
Cd3H12C12O18
45
148
623.78
mp-2230099
10.668252
8.929023
2.262477
other
Gd6Mg1W1O12
20
148
294.49
mp-643896
11.02122
4.240242
-3.717521
other
Na2Hf1H6O6
15
148
152.71
mp-2229997
10.948345
8.79414
2.463889
other
Ho6Mg1W1O12
20
148
279.39
mp-2217896
12.705086
9.016171
-0.162536
other
Mg1Mn2Al2O6
11
148
113.95
mp-2223060
8.80318
14.045702
-0.39026
other
Mg1Mn2Zn2O6
11
148
118.56
mp-6026
8.602569
3.819956
-7.243083
other
Na2Mg1C2O6
11
148
119.87
mp-2218044
7.295073
12.935264
-1.267932
other
Mg1Cd2Co2O6
11
148
126.52
mp-1228392
6.483176
8.400629
0.17775
other
Ba2Ce1Pb1O6
10
148
170.77
mp-569387
1.109039
1.672299
-5.025905
other
Cs2Lu7C1Cl18
28
148
781.12
mp-2227343
6.834305
8.751125
-0.817377
other
Na2Mg1Bi2O6
11
148
162.02
mp-753899
8.275912
4.29341
-6.890848
other
Li4Fe4C8O24
40
148
365.72
mp-849749
14.90585
8.523997
-3.993619
other
Li4V4P4O16
28
148
336.29
mp-6425
13.345882
5.810665
-6.943515
other
Li6In4P6O24
40
148
485.69
mp-1180702
7.141301
0.166759
-3.962953
other
Li12B6H36N6
60
148
546.72
mp-2218042
12.408964
11.008788
1.664911
other
Mg1Ti2Sn2O6
11
148
156.98
mp-1303958
7.089653
13.261559
-1.42141
other
Li4Ni6Sb2O16
28
148
295.58