P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 18.394027 13.608296 23.806014 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.45370000 Y=0.25000000 Z=0.15780000
          MULT= 4          ISPLIT= 8
      -1: X=0.54630000 Y=0.75000000 Z=0.84220000
      -1: X=0.95370000 Y=0.25000000 Z=0.34220000
      -1: X=0.04630000 Y=0.75000000 Z=0.65780000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.15740000 Y=0.25000000 Z=0.88430000
          MULT= 4          ISPLIT= 8
      -2: X=0.84260000 Y=0.75000000 Z=0.11570000
      -2: X=0.65740000 Y=0.25000000 Z=0.61570000
      -2: X=0.34260000 Y=0.75000000 Z=0.38430000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.24805000 Y=0.25000000 Z=0.56811000
          MULT= 4          ISPLIT= 8
      -3: X=0.75195000 Y=0.75000000 Z=0.43189000
      -3: X=0.74805000 Y=0.25000000 Z=0.93189000
      -3: X=0.25195000 Y=0.75000000 Z=0.06811000
W          NPT=  781  R0=.000005000 RMT= 2.22        Z:  74.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.01526000 Y=0.25000000 Z=0.61001000
          MULT= 4          ISPLIT= 8
      -4: X=0.98474000 Y=0.75000000 Z=0.38999000
      -4: X=0.51526000 Y=0.25000000 Z=0.88999000
      -4: X=0.48474000 Y=0.75000000 Z=0.11001000
Se         NPT=  781  R0=.000050000 RMT= 2.11        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  -5: X=0.14679000 Y=0.00758000 Z=0.14021000
          MULT= 8          ISPLIT= 8
      -5: X=0.85321000 Y=0.99242000 Z=0.85979000
      -5: X=0.64679000 Y=0.00758000 Z=0.35979000
      -5: X=0.35321000 Y=0.99242000 Z=0.64021000
      -5: X=0.35321000 Y=0.50758000 Z=0.64021000
      -5: X=0.64679000 Y=0.49242000 Z=0.35979000
      -5: X=0.85321000 Y=0.50758000 Z=0.85979000
      -5: X=0.14679000 Y=0.49242000 Z=0.14021000
Se         NPT=  781  R0=.000050000 RMT= 2.11        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=0.28380000 Y=0.25000000 Z=0.38718000
          MULT= 4          ISPLIT= 8
      -6: X=0.71620000 Y=0.75000000 Z=0.61282000
      -6: X=0.78380000 Y=0.25000000 Z=0.11282000
      -6: X=0.21620000 Y=0.75000000 Z=0.88718000
Se         NPT=  781  R0=.000050000 RMT= 2.11        Z:  34.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000