P   LATTICE,NONEQUIV.ATOMS   6   52 Pnna                                       
MODE OF CALC=RELA unit=bohr                                                    
 11.151274 18.906710 18.103576 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.61690000 Y=0.15550000 Z=0.08480000
          MULT= 8          ISPLIT= 8
      -1: X=0.38310000 Y=0.84450000 Z=0.91520000
      -1: X=0.11690000 Y=0.15550000 Z=0.91520000
      -1: X=0.88310000 Y=0.84450000 Z=0.08480000
      -1: X=0.38310000 Y=0.65550000 Z=0.58480000
      -1: X=0.61690000 Y=0.34450000 Z=0.41520000
      -1: X=0.88310000 Y=0.65550000 Z=0.41520000
      -1: X=0.11690000 Y=0.34450000 Z=0.58480000
Sr         NPT=  781  R0=.000010000 RMT= 2.41        Z:  38.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.25000000 Y=0.00000000 Z=0.59570000
          MULT= 4          ISPLIT= 8
      -2: X=0.75000000 Y=0.00000000 Z=0.40430000
      -2: X=0.75000000 Y=0.50000000 Z=0.09570000
      -2: X=0.25000000 Y=0.50000000 Z=0.90430000
Sr         NPT=  781  R0=.000010000 RMT= 2.41        Z:  38.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.25000000 Y=0.00000000 Z=0.27000000
          MULT= 4          ISPLIT= 8
      -3: X=0.75000000 Y=0.00000000 Z=0.73000000
      -3: X=0.75000000 Y=0.50000000 Z=0.77000000
      -3: X=0.25000000 Y=0.50000000 Z=0.23000000
Al         NPT=  781  R0=.000100000 RMT= 1.81        Z:  13.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.16900000 Y=0.25000000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -4: X=0.83100000 Y=0.75000000 Z=0.75000000
      -4: X=0.66900000 Y=0.25000000 Z=0.75000000
      -4: X=0.33100000 Y=0.75000000 Z=0.25000000
Al         NPT=  781  R0=.000100000 RMT= 1.81        Z:  13.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -5: X=0.36840000 Y=0.35450000 Z=0.12850000
          MULT= 8          ISPLIT= 8
      -5: X=0.63160000 Y=0.64550000 Z=0.87150000
      -5: X=0.86840000 Y=0.35450000 Z=0.87150000
      -5: X=0.13160000 Y=0.64550000 Z=0.12850000
      -5: X=0.63160000 Y=0.85450000 Z=0.62850000
      -5: X=0.36840000 Y=0.14550000 Z=0.37150000
      -5: X=0.13160000 Y=0.85450000 Z=0.37150000
      -5: X=0.86840000 Y=0.14550000 Z=0.62850000
N          NPT=  781  R0=.000100000 RMT= 1.73        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.02060000 Y=0.09680000 Z=0.16910000
          MULT= 8          ISPLIT= 8
      -6: X=0.97940000 Y=0.90320000 Z=0.83090000
      -6: X=0.52060000 Y=0.09680000 Z=0.83090000
      -6: X=0.47940000 Y=0.90320000 Z=0.16910000
      -6: X=0.97940000 Y=0.59680000 Z=0.66910000
      -6: X=0.02060000 Y=0.40320000 Z=0.33090000
      -6: X=0.47940000 Y=0.59680000 Z=0.33090000
      -6: X=0.52060000 Y=0.40320000 Z=0.66910000
N          NPT=  781  R0=.000100000 RMT= 1.73        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000