P   LATTICE,NONEQUIV.ATOMS   4  136 P42/mnm                                    
MODE OF CALC=RELA unit=bohr                                                    
 20.192858 20.192858  7.282438 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.40099000 Y=0.59901000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.59901000 Y=0.40099000 Z=0.00000000
      -1: X=0.90099000 Y=0.90099000 Z=0.50000000
      -1: X=0.09901000 Y=0.09901000 Z=0.50000000
W          NPT=  781  R0=.000005000 RMT= 1.95        Z:  74.00000              
LOCAL ROT MATRIX:    0.0000000 0.7071068-0.7071068
                     0.0000000 0.7071068 0.7071068
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.37435000 Y=0.37435000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -2: X=0.62565000 Y=0.62565000 Z=0.00000000
      -2: X=0.12565000 Y=0.87435000 Z=0.50000000
      -2: X=0.87435000 Y=0.12565000 Z=0.50000000
Cl         NPT=  781  R0=.000100000 RMT= 2.00        Z:  17.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068 0.7071068
                     0.0000000 0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.18601000 Y=0.60170000 Z=0.00000000
          MULT= 8          ISPLIT= 8
      -3: X=0.81399000 Y=0.39830000 Z=0.00000000
      -3: X=0.89830000 Y=0.68601000 Z=0.50000000
      -3: X=0.10170000 Y=0.31399000 Z=0.50000000
      -3: X=0.31399000 Y=0.10170000 Z=0.50000000
      -3: X=0.68601000 Y=0.89830000 Z=0.50000000
      -3: X=0.39830000 Y=0.81399000 Z=0.00000000
      -3: X=0.60170000 Y=0.18601000 Z=0.00000000
Cl         NPT=  781  R0=.000100000 RMT= 2.00        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.09110000 Y=0.09110000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -4: X=0.90890000 Y=0.90890000 Z=0.00000000
      -4: X=0.40890000 Y=0.59110000 Z=0.50000000
      -4: X=0.59110000 Y=0.40890000 Z=0.50000000
O          NPT=  781  R0=.000100000 RMT= 1.68        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068 0.7071068
                     0.0000000 0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000