P   LATTICE,NONEQUIV.ATOMS   6   11 P21/m   
MODE OF CALC=RELA unit=bohr
 12.037367  9.380601 15.796221 90.000000 90.000000 94.985000
ATOM  -1: X=0.29497000 Y=0.03027000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -1: X=0.70503000 Y=0.96973000 Z=0.75000000
Re         NPT=  781  R0=.000005000 RMT=   2.00000   Z:  75.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.73670000 Y=0.42500000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -2: X=0.26330000 Y=0.57500000 Z=0.75000000
Cl         NPT=  781  R0=.000100000 RMT=   2.00000   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  -3: X=0.03900000 Y=0.81100000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -3: X=0.96100000 Y=0.18900000 Z=0.75000000
F          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   9.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.62000000 Y=0.19900000 Z=0.59730000
          MULT= 4          ISPLIT=15
      -4: X=0.38000000 Y=0.80100000 Z=0.40270000
      -4: X=0.38000000 Y=0.80100000 Z=0.09730000
      -4: X=0.62000000 Y=0.19900000 Z=0.90270000
F          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   9.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.17700000 Y=0.22300000 Z=0.09300000
          MULT= 4          ISPLIT=15
      -5: X=0.82300000 Y=0.77700000 Z=0.90700000
      -5: X=0.82300000 Y=0.77700000 Z=0.59300000
      -5: X=0.17700000 Y=0.22300000 Z=0.40700000
F          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   9.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.53200000 Y=0.23100000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -6: X=0.46800000 Y=0.76900000 Z=0.75000000
N          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   7.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000