P   LATTICE,NONEQUIV.ATOMS   3  127 P4/mbm                                     
MODE OF CALC=RELA unit=bohr                                                    
 10.077343 10.077343  6.700591 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT=-2
      -1: X=0.50000000 Y=0.50000000 Z=0.00000000
Y          NPT=  781  R0=.000010000 RMT= 2.50000     Z:  39.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.13620000 Y=0.63620000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -2: X=0.86380000 Y=0.36380000 Z=0.50000000
      -2: X=0.36380000 Y=0.13620000 Z=0.50000000
      -2: X=0.63620000 Y=0.86380000 Z=0.50000000
B          NPT=  781  R0=.000100000 RMT= 1.39        Z:   5.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068 0.7071068
                     0.0000000 0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.66190000 Y=0.16190000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -3: X=0.33810000 Y=0.83810000 Z=0.50000000
      -3: X=0.83810000 Y=0.66190000 Z=0.50000000
      -3: X=0.16190000 Y=0.33810000 Z=0.50000000
C          NPT=  781  R0=.000100000 RMT= 1.47        Z:   6.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068 0.7071068
                     0.0000000 0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000