P   LATTICE,NONEQUIV.ATOMS   2   61 Pbca                                       
MODE OF CALC=RELA unit=bohr                                                    
 11.325129 14.775769 15.138596 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.45400000 Y=0.36900000 Z=0.35000000
          MULT= 8          ISPLIT= 8
      -1: X=0.54600000 Y=0.63100000 Z=0.65000000
      -1: X=0.95400000 Y=0.36900000 Z=0.15000000
      -1: X=0.04600000 Y=0.63100000 Z=0.85000000
      -1: X=0.04600000 Y=0.86900000 Z=0.35000000
      -1: X=0.95400000 Y=0.13100000 Z=0.65000000
      -1: X=0.54600000 Y=0.86900000 Z=0.15000000
      -1: X=0.45400000 Y=0.13100000 Z=0.85000000
Cd         NPT=  781  R0=.000010000 RMT= 2.47        Z:  48.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.14100000 Y=0.05700000 Z=0.09800000
          MULT= 8          ISPLIT= 8
      -2: X=0.85900000 Y=0.94300000 Z=0.90200000
      -2: X=0.64100000 Y=0.05700000 Z=0.40200000
      -2: X=0.35900000 Y=0.94300000 Z=0.59800000
      -2: X=0.35900000 Y=0.55700000 Z=0.09800000
      -2: X=0.64100000 Y=0.44300000 Z=0.90200000
      -2: X=0.85900000 Y=0.55700000 Z=0.40200000
      -2: X=0.14100000 Y=0.44300000 Z=0.59800000
As         NPT=  781  R0=.000050000 RMT= 2.32        Z:  33.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000