P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 18.617771 14.619488 12.705007 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.06500000 Y=0.05600000 Z=0.19700000
          MULT= 8          ISPLIT= 8
      -1: X=0.93500000 Y=0.94400000 Z=0.80300000
      -1: X=0.56500000 Y=0.05600000 Z=0.30300000
      -1: X=0.43500000 Y=0.94400000 Z=0.69700000
      -1: X=0.43500000 Y=0.55600000 Z=0.69700000
      -1: X=0.56500000 Y=0.44400000 Z=0.30300000
      -1: X=0.93500000 Y=0.55600000 Z=0.80300000
      -1: X=0.06500000 Y=0.44400000 Z=0.19700000
Ti         NPT=  781  R0=.000050000 RMT= 2.27        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=0.22000000 Y=0.25000000 Z=0.83400000
          MULT= 4          ISPLIT= 8
      -2: X=0.78000000 Y=0.75000000 Z=0.16600000
      -2: X=0.72000000 Y=0.25000000 Z=0.66600000
      -2: X=0.28000000 Y=0.75000000 Z=0.33400000
Ti         NPT=  781  R0=.000050000 RMT= 2.27        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=0.00300000 Y=0.25000000 Z=0.52600000
          MULT= 4          ISPLIT= 8
      -3: X=0.99700000 Y=0.75000000 Z=0.47400000
      -3: X=0.50300000 Y=0.25000000 Z=0.97400000
      -3: X=0.49700000 Y=0.75000000 Z=0.02600000
Ti         NPT=  781  R0=.000050000 RMT= 2.27        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=0.28700000 Y=0.25000000 Z=0.33400000
          MULT= 4          ISPLIT= 8
      -4: X=0.71300000 Y=0.75000000 Z=0.66600000
      -4: X=0.78700000 Y=0.25000000 Z=0.16600000
      -4: X=0.21300000 Y=0.75000000 Z=0.83400000
Ti         NPT=  781  R0=.000050000 RMT= 2.27        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=0.48100000 Y=0.25000000 Z=0.58500000
          MULT= 4          ISPLIT= 8
      -5: X=0.51900000 Y=0.75000000 Z=0.41500000
      -5: X=0.98100000 Y=0.25000000 Z=0.91500000
      -5: X=0.01900000 Y=0.75000000 Z=0.08500000
As         NPT=  781  R0=.000050000 RMT= 2.27        Z:  33.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.32500000 Y=0.00900000 Z=0.06800000
          MULT= 8          ISPLIT= 8
      -6: X=0.67500000 Y=0.99100000 Z=0.93200000
      -6: X=0.82500000 Y=0.00900000 Z=0.43200000
      -6: X=0.17500000 Y=0.99100000 Z=0.56800000
      -6: X=0.17500000 Y=0.50900000 Z=0.56800000
      -6: X=0.82500000 Y=0.49100000 Z=0.43200000
      -6: X=0.67500000 Y=0.50900000 Z=0.93200000
      -6: X=0.32500000 Y=0.49100000 Z=0.06800000
As         NPT=  781  R0=.000050000 RMT= 2.27        Z:  33.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000