MGO (001) surface - 1 layer slab
CRYSTAL
0 0 0
 225
4.21
2
 12 0.    0.    0.
  8 0.5   0.5   0.5
SLABCUT
0 0 1    Miller indices of the surface
1 1      surface layer, number of layers (1 3, 3-layer slab)
END
12  3
 0  0  8  2.  1.
 68371.875      0.0002226
  9699.34009    0.0018982
  2041.176786   0.0110451
   529.862906   0.0500627
   159.186000   0.169123
    54.6848     0.367031
    21.2357     0.400410
     8.74604    0.14987
0 1 6 8. 1.
156.795  -0.00624  0.00772
31.0339  -0.07882  0.06427
9.6453   -0.07992  0.2104
3.7109    0.29063  0.34314
1.61164   0.57164  0.3735
0.64294   0.30664  0.23286
0 1 1 0. 1.
0.4       1.       1.
8 3
0 0 8 2. 1.
4000.    0.00144
1355.58  0.00764
248.545  0.05370
69.5339  0.16818
23.8868  0.36039
9.27593  0.38612
3.82034  0.14712
1.23514  0.07105
0 1 5 8. 1.
52.1878 -0.00873  0.00922
10.3293 -0.08979  0.07068
3.21034 -0.04079  0.20433
1.23514  0.37666  0.34958
0.536420 0.42248  0.27774
0 1 1 0. 1.
0.210000 1.  1.
99   0
END
TOLINTEG
7 7 7 7 14
SHRINK
8 8
FMIXING
30
END