P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 18.420105 14.060129 12.293802 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.07220000 Y=0.05332000 Z=0.19203000
          MULT= 8          ISPLIT= 8
      -1: X=0.92780000 Y=0.94668000 Z=0.80797000
      -1: X=0.57220000 Y=0.05332000 Z=0.30797000
      -1: X=0.42780000 Y=0.94668000 Z=0.69203000
      -1: X=0.42780000 Y=0.55332000 Z=0.69203000
      -1: X=0.57220000 Y=0.44668000 Z=0.30797000
      -1: X=0.92780000 Y=0.55332000 Z=0.80797000
      -1: X=0.07220000 Y=0.44668000 Z=0.19203000
Ti         NPT=  781  R0=.000050000 RMT= 2.47        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=0.22756000 Y=0.25000000 Z=0.83655000
          MULT= 4          ISPLIT= 8
      -2: X=0.77244000 Y=0.75000000 Z=0.16345000
      -2: X=0.72756000 Y=0.25000000 Z=0.66345000
      -2: X=0.27244000 Y=0.75000000 Z=0.33655000
Ti         NPT=  781  R0=.000050000 RMT= 2.47        Z:  22.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.29356000 Y=0.25000000 Z=0.35132000
          MULT= 4          ISPLIT= 8
      -3: X=0.70644000 Y=0.75000000 Z=0.64868000
      -3: X=0.79356000 Y=0.25000000 Z=0.14868000
      -3: X=0.20644000 Y=0.75000000 Z=0.85132000
Ti         NPT=  781  R0=.000050000 RMT= 2.47        Z:  22.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.00142000 Y=0.25000000 Z=0.53000000
          MULT= 4          ISPLIT= 8
      -4: X=0.99858000 Y=0.75000000 Z=0.47000000
      -4: X=0.50142000 Y=0.25000000 Z=0.97000000
      -4: X=0.49858000 Y=0.75000000 Z=0.03000000
Ti         NPT=  781  R0=.000050000 RMT= 2.47        Z:  22.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.32673000 Y=0.00927000 Z=0.06897000
          MULT= 8          ISPLIT= 8
      -5: X=0.67327000 Y=0.99073000 Z=0.93103000
      -5: X=0.82673000 Y=0.00927000 Z=0.43103000
      -5: X=0.17327000 Y=0.99073000 Z=0.56897000
      -5: X=0.17327000 Y=0.50927000 Z=0.56897000
      -5: X=0.82673000 Y=0.49073000 Z=0.43103000
      -5: X=0.67327000 Y=0.50927000 Z=0.93103000
      -5: X=0.32673000 Y=0.49073000 Z=0.06897000
P          NPT=  781  R0=.000100000 RMT= 2.02        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.48567000 Y=0.25000000 Z=0.58033000
          MULT= 4          ISPLIT= 8
      -6: X=0.51433000 Y=0.75000000 Z=0.41967000
      -6: X=0.98567000 Y=0.25000000 Z=0.91967000
      -6: X=0.01433000 Y=0.75000000 Z=0.08033000
P          NPT=  781  R0=.000100000 RMT= 2.02        Z:  15.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000