P   LATTICE,NONEQUIV.ATOMS   3   62 Pnma    
MODE OF CALC=RELA unit=bohr
 13.449181  7.793231 16.022988 90.000000 90.000000 90.000000
ATOM  -1: X=0.24800000 Y=0.25000000 Z=0.37700000
          MULT= 4          ISPLIT=15
      -1: X=0.75200000 Y=0.75000000 Z=0.62300000
      -1: X=0.74800000 Y=0.25000000 Z=0.12300000
      -1: X=0.25200000 Y=0.75000000 Z=0.87700000
U          NPT=  781  R0=.000005000 RMT=   2.00000   Z:  92.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.47100000 Y=0.25000000 Z=0.66600000
          MULT= 4          ISPLIT=15
      -2: X=0.52900000 Y=0.75000000 Z=0.33400000
      -2: X=0.97100000 Y=0.25000000 Z=0.83400000
      -2: X=0.02900000 Y=0.75000000 Z=0.16600000
S          NPT=  781  R0=.000100000 RMT=   2.00000   Z:  16.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.08600000 Y=0.25000000 Z=0.06600000
          MULT= 4          ISPLIT=15
      -3: X=0.91400000 Y=0.75000000 Z=0.93400000
      -3: X=0.58600000 Y=0.25000000 Z=0.43400000
      -3: X=0.41400000 Y=0.75000000 Z=0.56600000
S          NPT=  781  R0=.000100000 RMT=   2.00000   Z:  16.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000