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-557225
-4.602328
-1.138585
-5.707176
other
Cu12Ge2W2S16
32
186
617.89
mp-771820
7.141738
13.424994
-1.259472
other
Li4Ti2Fe6O16
28
186
292.42
mp-18611
9.318974
9.363883
1.043816
other
Ba12Ni4Sb8O36
60
186
869.21
mp-760296
11.100733
13.0729
0.133291
other
Li10Mn2Cr6O16
34
186
311.27
mp-1048392
12.427318
10.479335
0.61287
other
Ba2Y2V8O14
26
186
391.25
mp-18282
12.962773
11.103733
-0.420777
other
Sc2Zn2Mo6O16
26
186
332.52
mp-754888
6.700687
13.235952
-1.449067
other
Li4Cr2Fe6O16
28
186
289.73
mp-554479
12.89168
5.417904
-4.435791
other
Ba6B2P2O14
24
186
404.68
mp-757026
6.826845
14.201447
-1.857658
other
Li4Mn2Co6O16
28
186
255.47
mp-1214668
8.5858
3.82561
-6.912413
other
Ba6Na6C10O30
52
186
691.7
mp-761063
5.921702
12.889336
-1.580127
other
Li6Fe2Ni6O16
30
186
272.79
mp-1218679
11.413667
12.978968
-0.09909
other
Sr2Cr18Ga6O38
64
186
697.55
mp-759910
8.615839
15.000352
-0.602985
other
Li6Mn6Fe2O16
30
186
271.14
mp-1048118
12.693467
10.112047
1.811249
other
Ba2Y2Ti8O14
26
186
377.43
mp-1219120
9.348852
4.730401
-4.135481
other
Sm2H36Br6O36
80
186
843.06
mp-775874
11.11512
12.93486
1.115088
other
Li8Ti12Fe4O32
56
186
605.58
mp-10097
-4.681237
-5.540767
0.566089
other
Na6Sr6Ga2As8
22
186
618.4
mp-776085
12.487186
13.162828
-0.91866
other
Li4V6Sn2O16
28
186
296.21
mp-760328
6.096212
13.481522
-1.611368
other
Li6Co2Ni6O16
30
186
256.97
mp-17271
-3.820883
-4.062858
-3.856645
other
Sm8Fe2Se12O2
24
186
551.5
mp-1048141
7.344959
10.462466
-0.770766
other
Ba2Al2Cu8O14
26
186
307.65
mp-8075
12.00731
6.347987
-2.089697
other
Na2Be8Sb2O14
26
186
233.27
mp-6778
2.598175
2.265541
1.678088
other
Ba2Yb2Si8N14
26
186
323.39
mp-562270
7.409398
12.047226
-1.03861
other
Ba2Yb2Co8O14
26
186
363.58
mp-696695
8.957711
3.770664
-7.038349
other
Ba2Ca2C2O6
12
186
320.33
mp-765293
6.987347
14.120147
-1.819575
other
Li4Cr2Co6O16
28
186
261.6
mp-23985
9.152673
4.728612
-4.210007
other
Li2H12Br2O14
30
186
307.82
mp-760316
8.872916
14.038018
-1.008801
other
Li6V2Fe6O16
30
186
290.39
mp-1048115
7.588286
10.314503
-0.291052
other
Ba2Y2Cu8O14
26
186
360.64
mp-570084
-4.514652
-2.582778
-4.029078
other
Hg6As2Se8I2
18
186
576.53
mp-1048425
12.649937
9.83047
0.515043
other
Ba2Y2W8O14
26
186
402.93
mp-1210373
8.641645
3.668255
-7.141519
other
Na4Ca2C4O12
22
186
272.47
mp-16841
-3.727537
-4.010544
-3.878644
other
La8Mn2Se12O2
24
186
598
mp-1048366
10.109509
11.418581
0.810932
other
Ba2Y2Mn8O14
26
186
402.86
mp-17703
7.921625
11.594796
-0.452507
other
Ba2Ho2Co8O14
26
186
367.08
mp-557816
9.910849
11.23964
0.730097
other
Ba10Li4W6O30
50
186
720.5
mp-556875
-3.742694
-4.025764
-3.864167
other
La8Fe2Se12O2
24
186
591.05
mp-18274
9.869029
10.520775
3.371585
other
Ba8Li2Nb6O24
40
186
582.34
mp-1228376
8.667192
11.425248
0.916502
other
Ba6Fe4W2O18
30
186
427.79
mp-759690
10.188693
2.057675
-3.780579
other
Mn2H16N4F12
34
186
292.19
mp-1193473
9.928208
9.40982
0.159381
other
K2Zn8Sb2O14
26
186
340.53
mp-1048423
12.621314
9.800596
0.50588
other
Ba2Al2W8O14
26
186
359.68
mp-771712
8.557367
13.416396
-0.943011
other
Li4Fe6Sb2O16
28
186
305.52
mp-16792
9.855185
10.604589
3.4183
other
Ba8Li2Ta6O24
40
186
576.28
mp-772613
9.12086
13.803048
-1.181423
other
Li4Cr6Ni2O16
28
186
283.44
mp-771076
12.354218
12.562143
1.208582
other
Li4Ti6V2O16
28
186
300.63
mp-777904
11.816762
12.750703
1.391883
other
Li4Ti6Cr2O16
28
186
290.38
mp-1078415
10.807755
8.70807
2.413879
other
Ca2Fe2S2O2
8
186
142.22
mp-756067
12.592012
12.716276
-0.718629
other
Li4V6Sb2O16
28
186
305.64
mp-1228445
8.447062
10.806869
0.776507
other
Ba6Fe4Te2O18
30
186
430.51
mp-753235
9.287902
14.079185
-0.842101
other
Li4Mn6Te2O16
28
186
315.24
mp-1048345
12.717295
10.716595
0.185729
other
Ba2Al2V8O14
26
186
331.92
mp-774449
12.31838
12.009196
1.519601
other
Li4Ti6Sb2O16
28
186
324.7
mp-1220119
9.363758
4.727138
-4.136001
other
Pr2H36Br6O36
80
186
860.63
mp-757012
12.737595
13.042151
-0.348799
other
Li6Ti2V6O16
30
186
292.98
mp-542286
7.568294
10.623902
1.111336
other
Ba8Na2Ru6O24
40
186
581.79
mp-540739
7.541925
10.470433
1.063849
other
Ba6Y2Ir4O18
30
186
454.62
mp-555217
9.584561
6.920761
-3.567787
other
Dy6Se8O24F2
40
186
628.16
mp-772612
10.574903
13.835583
-0.523097
other
Li4Ti2Cr6O16
28
186
284.67
mp-558143
-2.181859
-2.296652
-5.321017
other
Pr8S6N2Cl6
22
186
534.94
mp-759916
6.454151
14.085126
-1.805387
other
Li6Co6Ni2O16
30
186
254.91
mp-567949
-4.40967
-2.275759
-4.138289
other
Hg6As2Se8Br2
18
186
518.77
mp-18292
-2.51065
-2.899643
-5.510486
other
La8Mn2S12O2
24
186
537.54
mp-1048387
11.134668
10.977632
0.466822
other
Ba2Y2Fe8O14
26
186
389.8
mp-757930
7.742136
13.80282
-1.530842
other
Li4Co6Sb2O16
28
186
270.15
mp-760333
11.919023
12.6593
0.132665
other
Li10V2Cr6O16
34
186
309.47
mp-16868
7.907573
11.750793
-0.522516
other
Ba2Lu2Co8O14
26
186
359.44
mp-753728
10.19356
13.830089
-0.649562
other
Li4Cr6Sn2O16
28
186
297.66
mp-17340
-3.815926
-4.062362
-3.850933
other
Nd8Mn2Se12O2
24
186
575.98
mp-19151
7.929774
11.693922
-0.591585
other
Ba2Y2Co8O14
26
186
369.68
mp-554511
-2.464042
-0.236789
-4.834086
other
Cu14P24S18Cl14
70
186
1,531.78
mp-7204
9.757773
8.173617
2.138947
other
Ca2Zn2S2O2
8
186
142.41
mp-17313
12.536973
7.485803
0.506893
other
Mg6Be2Al16O32
56
186
528.16
mp-775204
12.811281
12.41297
-0.591442
other
Li4V6W2O16
28
186
305.32
mp-756196
6.392156
13.841775
-1.979335
other
Li4Co6Ni2O16
28
186
260.28
mp-22517
2.748097
2.243551
1.787784
other
Eu2Y2Si8N14
26
186
312.94
mp-771832
12.306011
12.115791
1.508287
other
Li4Ti6Sn2O16
28
186
311.83
mp-1048458
10.366742
12.215528
0.446333
other
Ba2Mn8Al2O14
26
186
346.04
mp-757835
7.348317
13.942784
-1.760317
other
Li4V2Co6O16
28
186
257.72
mp-644222
10.062523
3.55492
-4.012512
other
Cd2H2Cl2O2
8
186
125.88
mp-10096
-3.315153
-4.697755
0.793413
other
Na6Sr6Ga2P8
22
186
570.49
mp-772420
6.910586
14.107908
-1.760375
other
Li4Co6Sn2O16
28
186
276.69
mp-601817
7.130122
1.532853
-3.968164
other
Cu8H6C4N10
28
186
314.94
mp-777480
11.049706
13.089078
1.272055
other
Li8Ti12Mn4O32
56
186
613.05
mp-770757
6.800226
13.665901
-1.330193
other
Li4Mn2Fe6O16
28
186
288.71
mp-771960
7.811373
12.923637
-1.280138
other
Li4Ni6Te2O16
28
186
287.22
mp-1189370
2.646695
-0.289915
-1.756395
other
Ce4Zn4Sn4H6
18
186
302.05
mp-559447
9.542434
6.960966
-3.480939
other
Gd6Se8O24F2
40
186
654.17
mp-1048544
12.163297
11.110663
0.402461
other
Ba2Al2Cr8O14
26
186
338.28
mp-778197
11.024525
13.085649
-0.223919
other
Li4Cr6Te2O16
28
186
303.82
mp-22402
8.075688
11.994811
-0.969731
other
Ba2In2Co8O14
26
186
353.56
mp-23785
9.388178
5.294773
-4.570653
other
Li2Mn2H12O14
30
186
295.42
mp-561050
12.033415
6.538827
0.204586
other
Ba8Ca8Si8O32
56
186
819.69
mp-761172
7.266371
14.355178
-1.463011
other
Li6Ti2Co6O16
30
186
260.63
mp-771959
9.252898
13.788764
-0.838276
other
Li4Mn6W2O16
28
186
294
mp-771708
7.091862
13.331497
-1.416629
other
Li4Ni6Sb2O16
28
186
282.56
mp-558146
5.815482
4.820878
-4.297436
other
Fe2N6Cl2O6
16
186
325.85
mp-757856
6.300189
13.790973
-1.873852
other
Li4Fe2Co6O16
28
186
251.21
mp-559514
-2.369516
-2.474719
-5.345726
other
Nd8S6N2Cl6
22
186
523.69
mp-18804
7.933095
11.60641
-0.53956
other
Ba2Dy2Co8O14
26
186
351.86