P   LATTICE,NONEQUIV.ATOMS   4   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 10.738747 14.389698 10.086602 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.50000000 Y=0.00000000 Z=0.50000000
      -1: X=0.50000000 Y=0.50000000 Z=0.50000000
      -1: X=0.00000000 Y=0.50000000 Z=0.00000000
Ti         NPT=  781  R0=.000050000 RMT= 1.99        Z:  22.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.42760000 Y=0.25000000 Z=0.01990000
          MULT= 4          ISPLIT= 8
      -2: X=0.57240000 Y=0.75000000 Z=0.98010000
      -2: X=0.92760000 Y=0.25000000 Z=0.48010000
      -2: X=0.07240000 Y=0.75000000 Z=0.51990000
Y          NPT=  781  R0=.000010000 RMT= 2.19        Z:  39.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.54170000 Y=0.25000000 Z=0.62130000
          MULT= 4          ISPLIT= 8
      -3: X=0.45830000 Y=0.75000000 Z=0.37870000
      -3: X=0.04170000 Y=0.25000000 Z=0.87870000
      -3: X=0.95830000 Y=0.75000000 Z=0.12130000
O          NPT=  781  R0=.000100000 RMT= 1.80        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.19090000 Y=0.05700000 Z=0.30880000
          MULT= 8          ISPLIT= 8
      -4: X=0.80910000 Y=0.94300000 Z=0.69120000
      -4: X=0.69090000 Y=0.05700000 Z=0.19120000
      -4: X=0.30910000 Y=0.94300000 Z=0.80880000
      -4: X=0.30910000 Y=0.55700000 Z=0.80880000
      -4: X=0.69090000 Y=0.44300000 Z=0.19120000
      -4: X=0.80910000 Y=0.55700000 Z=0.69120000
      -4: X=0.19090000 Y=0.44300000 Z=0.30880000
O          NPT=  781  R0=.000100000 RMT= 1.80        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000