CXY LATTICE,NONEQUIV.ATOMS   9   63 Cmcm                                       
MODE OF CALC=RELA unit=bohr                                                    
 25.339338 24.914149 20.531874 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.55340000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.44660000 Z=0.75000000
Se         NPT=  781  R0=.000050000 RMT= 2.31        Z:  34.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.14100000 Y=0.34970000 Z=0.07750000
          MULT= 8          ISPLIT= 8
      -2: X=0.85900000 Y=0.65030000 Z=0.92250000
      -2: X=0.14100000 Y=0.34970000 Z=0.42250000
      -2: X=0.85900000 Y=0.65030000 Z=0.57750000
      -2: X=0.85900000 Y=0.34970000 Z=0.07750000
      -2: X=0.14100000 Y=0.65030000 Z=0.92250000
      -2: X=0.85900000 Y=0.34970000 Z=0.42250000
      -2: X=0.14100000 Y=0.65030000 Z=0.57750000
Se         NPT=  781  R0=.000050000 RMT= 2.31        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.00000000 Y=0.14810000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -3: X=0.00000000 Y=0.85190000 Z=0.75000000
Se         NPT=  781  R0=.000050000 RMT= 2.31        Z:  34.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.00000000 Y=0.15680000 Z=0.58170000
          MULT= 4          ISPLIT= 8
      -4: X=0.00000000 Y=0.84320000 Z=0.41830000
      -4: X=0.00000000 Y=0.15680000 Z=0.91830000
      -4: X=0.00000000 Y=0.84320000 Z=0.08170000
Se         NPT=  781  R0=.000050000 RMT= 2.31        Z:  34.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -5: X=0.23110000 Y=0.04340000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -5: X=0.76890000 Y=0.95660000 Z=0.75000000
      -5: X=0.76890000 Y=0.04340000 Z=0.25000000
      -5: X=0.23110000 Y=0.95660000 Z=0.75000000
Se         NPT=  781  R0=.000050000 RMT= 2.31        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.00000000 Y=0.25150000 Z=0.08350000
          MULT= 4          ISPLIT= 8
      -6: X=0.00000000 Y=0.74850000 Z=0.91650000
      -6: X=0.00000000 Y=0.25150000 Z=0.41650000
      -6: X=0.00000000 Y=0.74850000 Z=0.58350000
Si         NPT=  781  R0=.000100000 RMT= 1.80        Z:  14.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -7: X=0.13440000 Y=0.44950000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -7: X=0.86560000 Y=0.55050000 Z=0.75000000
      -7: X=0.86560000 Y=0.44950000 Z=0.25000000
      -7: X=0.13440000 Y=0.55050000 Z=0.75000000
Si         NPT=  781  R0=.000100000 RMT= 1.80        Z:  14.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.14940000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -8: X=0.85060000 Y=0.00000000 Z=0.00000000
      -8: X=0.14940000 Y=0.00000000 Z=0.50000000
      -8: X=0.85060000 Y=0.00000000 Z=0.50000000
Na         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  11.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -9: X=0.32950000 Y=0.25040000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -9: X=0.67050000 Y=0.74960000 Z=0.75000000
      -9: X=0.67050000 Y=0.25040000 Z=0.25000000
      -9: X=0.32950000 Y=0.74960000 Z=0.75000000
Na         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  11.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000