P   LATTICE,NONEQUIV.ATOMS   3   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 16.544552 12.576127  8.787227 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.18476000 Y=0.25000000 Z=0.01985000
          MULT= 4          ISPLIT= 8
      -1: X=0.81524000 Y=0.75000000 Z=0.98015000
      -1: X=0.68476000 Y=0.25000000 Z=0.48015000
      -1: X=0.31524000 Y=0.75000000 Z=0.51985000
I          NPT=  781  R0=.000010000 RMT= 1.85        Z:  53.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.16690000 Y=0.54360000 Z=0.08470000
          MULT= 8          ISPLIT= 8
      -2: X=0.83310000 Y=0.45640000 Z=0.91530000
      -2: X=0.66690000 Y=0.54360000 Z=0.41530000
      -2: X=0.33310000 Y=0.45640000 Z=0.58470000
      -2: X=0.33310000 Y=0.04360000 Z=0.58470000
      -2: X=0.66690000 Y=0.95640000 Z=0.41530000
      -2: X=0.83310000 Y=0.04360000 Z=0.91530000
      -2: X=0.16690000 Y=0.95640000 Z=0.08470000
F          NPT=  781  R0=.000100000 RMT= 1.67        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  -3: X=0.06450000 Y=0.25000000 Z=0.35280000
          MULT= 4          ISPLIT= 8
      -3: X=0.93550000 Y=0.75000000 Z=0.64720000
      -3: X=0.56450000 Y=0.25000000 Z=0.14720000
      -3: X=0.43550000 Y=0.75000000 Z=0.85280000
F          NPT=  781  R0=.000100000 RMT= 1.67        Z:   9.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000