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-2713959
12.126688
3.889313
-8.218041
other
La6Al6S18O72
102
150
1,589.69
mp-757212
8.448048
3.700603
-7.339861
other
Li3V3C6O18
30
150
300.43
mp-556458
8.596045
3.653178
-6.994144
other
Ba3Ca3C6O18
30
150
417.6
mp-1213738
8.395451
6.381804
-5.527464
other
Cr1S2N1O8
12
150
180.35
mp-1208013
10.070775
4.645924
-6.927396
other
Tl1V1S2O8
12
150
194.61
mp-554477
6.804831
11.365686
1.558943
other
Ba12Na3Mn6O27
48
150
753.74
mp-1213156
8.863219
6.953521
-3.807579
other
Cs1Fe1Se2O8
12
150
217.98
mp-1210957
9.678027
1.523132
1.456702
other
Li3Ti3Ni3F18
27
150
307.54
mp-17467
9.805894
1.992486
1.914057
other
Li3Ti3Mn3F18
27
150
325.15
mp-550081
7.475569
10.271234
1.268132
other
Ba2La1Ir1O6
10
148
161.38
mp-510002
10.962529
4.277792
-4.091526
other
K2Sn1H6O6
15
148
163.52
mp-1218742
9.667062
8.886596
2.122574
other
Sr2Pr2Pt1O6
11
148
189.7
mp-1078906
9.910092
9.48806
-1.391402
other
Co4Te4Pb8O24
40
148
534.09
mp-557228
7.729302
6.672516
-3.035174
other
Rb2Mo1I6O18
27
148
470.09
mp-1202083
11.888232
7.465624
-4.382926
other
Sr1Zr4As6O24
35
148
591.7
mp-1274653
6.351793
10.175921
0.27051
other
La4Mg2Co2O12
20
148
244.03
mp-552176
9.49952
9.647588
3.482345
other
Ba2Pr1Nb1O6
10
148
165.31
mp-17499
10.172613
4.383591
-7.000087
other
K7Nb1S6O24
38
148
653.25
mp-2217954
8.554773
12.740041
-0.39995
other
Mg1Mn2Tl2O6
11
148
143.26
mp-23731
12.015522
5.277294
-3.153402
other
Cu6Si6H12O24
48
148
491.19
mp-568428
5.337967
-0.431695
-2.998542
other
K1Na1B2H8
12
148
131.73
mp-1272890
6.243607
10.75292
0.645934
other
La4Zn2Co2O12
20
148
239.15
mp-752552
8.941388
3.409256
-7.826536
other
Li8V4C8O24
44
148
448.87
mp-17025
13.438016
4.658641
-1.391715
other
Sr6Y2B6O18
32
148
435.65
mp-1019528
13.784294
4.330379
-2.076848
other
Ba2Mg1B6O12
21
148
251.77
mp-730823
10.825123
3.230285
-4.579117
other
P6H24N6O19
55
148
535.21
mp-18990
13.900118
4.426407
-2.18325
other
Ba8Mn4B24O48
84
148
1,040.15
mp-26883
14.739914
7.778752
-4.707774
other
Li6Ti4P6O24
40
148
477.26
mp-1444903
9.644691
9.020389
2.451594
other
La2Mg1Sn1O6
10
148
132.68
mp-2217730
6.594663
13.293749
-1.732217
other
Mg1Co2Ag2O6
11
148
126.98
mp-14871
2.027649
2.302909
1.418178
other
Li16Ta2N8O1
27
148
265.69
mp-1233115
11.426123
10.135392
1.541792
other
La2Mg1Mo1O6
10
148
130.42
mp-2217599
8.329273
13.986713
-0.885443
other
Mg1Mn2Tl2O6
11
148
166.61
mp-1203172
8.234967
8.909828
-3.969022
other
U1Cu1Mo12O54
68
148
1,101.3
mp-643788
10.892093
4.311817
-4.163453
other
Na2Sn1H6O6
15
148
172.45
mp-762019
8.644087
3.539358
-7.435727
other
Li1V1C2O6
10
148
97.11
mp-1403741
10.437998
9.170583
2.08003
other
La2Mg1Sb1O6
10
148
138.28
mp-2217622
12.300397
11.966215
0.812639
other
Mg1Ti2Co2O6
11
148
117.06
mp-1282711
8.084723
4.749039
-6.679073
other
Li4Co4C8O24
40
148
386.35
mp-1078209
5.725007
10.354364
-0.394487
other
Li2La4Fe2O12
20
148
223.69
mp-777465
14.503633
8.446668
-3.858128
other
Li6P6W4O24
40
148
509.99
mp-1393845
8.216318
8.686914
1.644783
other
La2Mg1Bi1O6
10
148
145.72
mp-2217989
10.30797
9.500054
-0.219933
other
Mg1Tl2Sb2O6
11
148
217.85
mp-1235053
8.994196
11.012751
0.345242
other
Rb2Li1Os2O6
11
148
167.89
mp-761135
13.953779
7.210546
-5.828963
other
Li6Sb4P6O24
40
148
559.79
mp-1273081
6.259624
10.665631
0.841607
other
Ca2La4Co2O12
20
148
263.4
mp-1232521
13.989877
4.678458
-2.325468
other
Y4Cr4B8O24
40
148
422.96
mp-2217584
11.990506
8.159313
-1.01839
other
Mg1Al2Co2O6
11
148
107.02
mp-560586
13.626989
5.715631
-7.435874
other
Rb2Ti4P6O24
36
148
486.82
mp-2240086
9.649587
8.662315
-0.04839
other
Mg1Cd2Bi2O6
11
148
168.03
mp-1104428
8.221642
2.977435
-1.458337
other
Hf1Ni1O6F6
14
148
204.82
mp-1215572
10.081587
6.61763
-2.921215
other
Yb1Sc1B2O6
10
148
113.46
mp-1400776
8.114782
8.953964
1.569358
other
La2Zn1Bi1O6
10
148
146
mp-1222080
8.661843
3.815258
-7.121944
other
Mg1Cd1C2O6
10
148
107.4
mp-1147642
9.904929
9.753071
2.83352
other
Ba2Nb1Bi1O6
10
148
164.48
mp-2223665
8.655363
13.177686
-0.969746
other
Mg1Fe2Ni2O6
11
148
113.71
mp-753624
14.393049
7.619617
-6.967595
other
Li2Mn2P2O8
14
148
171.98
mp-1179169
6.330766
1.000331
-3.587605
other
Sr1B12H12O8
33
148
386.56
mp-2217721
8.664594
13.927583
-1.016359
other
Mg1Mn2Ni2O6
11
148
114.22
mp-1194836
7.853642
3.005486
-3.479656
other
Ba6C24O24F36
90
148
1,438.3
mp-1394560
11.262273
10.010265
1.564579
other
Ca1La2Mo1O6
10
148
146.52
mp-2217335
11.974348
11.936245
0.493749
other
Mg1Ti2Ni2O6
11
148
113.48
mp-1410589
10.172186
9.037045
2.108842
other
Ca1La2Sb1O6
10
148
156.63
mp-1078391
8.542422
3.732531
-6.916075
other
Ca1Zn1C2O6
10
148
111.64
mp-542919
13.007623
5.738294
-7.58305
other
Na2Ge4P6O24
36
148
425.91
mp-703593
9.111378
7.576851
-5.349108
other
Zn6P12H12O36
66
148
1,045.36
mp-18203
13.021486
5.818686
-7.482028
other
K2Ge4P6O24
36
148
436.43
mp-2224461
12.589293
11.0344
1.628457
other
Mg1Ti2Zn2O6
11
148
117.59
mp-1201654
12.036469
6.491321
-6.197759
other
Cu6P6H6O24
42
148
488.57
mp-2217895
12.097692
11.021314
1.760699
other
Mg1Ti2Sn2O6
11
148
157.36
mp-770365
12.348486
11.769023
-2.237284
other
Li6Al6V6O24
42
148
545.48
mp-26275
9.529572
7.974067
-5.970107
other
Li6Ni4P6O24
40
148
468.54
mp-2217878
12.575823
9.071497
0.029124
other
Mg1Mn2Al2O6
11
148
112.33
mp-775012
10.186097
8.2938
-6.826756
other
Li6Co4P6O24
40
148
444.08
mp-1194095
7.57698
6.565227
-3.06782
other
Ti1Ag2I6O18
27
148
409.92
mp-1398571
9.912322
10.041579
3.241892
other
La2Ti1Zn1O6
10
148
126.24
mp-1191060
2.946072
3.612284
-4.116877
other
Cr1Pb6Cl6O8
21
148
458.15
mp-23118
-1.169861
1.515193
-1.814329
other
Cs1Er6C1I12
20
148
769.1
mp-571150
-1.265579
1.896326
-2.170822
other
Cs2Zr7C1I18
28
148
1,034.47
mp-772425
10.150942
4.518609
-7.058143
other
Li6V2S6O24
38
148
448.83
mp-568478
1.363611
2.293021
-4.085917
other
Nb6Tl2V1Cl18
27
148
636.95
mp-1225475
13.532535
4.588208
-1.365107
other
Er1Sc1B2O6
10
148
110.74
mp-773098
9.552657
14.856959
-0.366527
other
Li4Mn3V1O8
16
148
153.72
mp-1200394
11.252085
4.809294
-5.455633
other
Fe2P6H12O12
32
148
379.84
mp-1385999
11.498319
9.913322
1.258153
other
Ca1La2W1O6
10
148
147.2
mp-1396966
8.118516
8.673069
1.467637
other
Ca1La2Bi1O6
10
148
168.22
mp-756818
12.142861
7.116905
-1.062221
other
Li6Si6Bi6O24
42
148
591.39
mp-1223724
-5.732376
1.507732
-4.790403
other
In1Mo12Pb1S16
30
148
572.18
mp-2217317
8.411315
13.368577
-0.712735
other
Mg1Zn2Fe2O6
11
148
120.65
mp-1235560
9.462852
10.748522
0.465577
other
Rb2Li1Os2O6
11
148
154.41
mp-2240275
8.686255
13.17193
-0.972232
other
Mg1Fe2Ni2O6
11
148
113.34
mp-17562
13.445641
4.630759
-1.409158
other
Sr6Sc2B6O18
32
148
390.78
mp-569112
1.554131
2.201907
1.37077
other
Li6Ca2Mn2N6
16
148
177.93
mp-753103
8.097006
4.755319
-6.669875
other
Li2Co2C4O12
20
148
190.76
mp-1019533
11.891459
6.685858
0.25498
other
Ba9Y2Si6O24
41
148
671.96
mp-1222101
8.693803
3.82313
-7.058108
other
Mg1Cd3C4O12
20
148
227.92
mp-554818
10.298052
9.208735
-2.034802
other
K2Te6O12F2
22
148
381.95
mp-19388
11.204413
7.65845
-4.252061
other
Ba2Ni4As4O16
26
148
352.04
mp-25929
12.824438
6.41258
-6.234479
other
Li6Bi4P6O24
40
148
571.83
mp-706405
9.424846
5.425905
-4.807222
other
Cd6P12H24O48
90
148
1,585.72