H   LATTICE,NONEQUIV.ATOMS   4  182 P6322                                      
MODE OF CALC=RELA unit=bohr                                                    
 10.873484 10.873484 23.474178 90.000000 90.000000120.000000                   
ATOM  -1: X=0.33333333 Y=0.66666667 Z=0.25000000
          MULT= 2          ISPLIT= 4
      -1: X=0.66666666 Y=0.33333333 Z=0.75000000
Ti         NPT=  781  R0=.000050000 RMT= 2.44        Z:  22.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                    -1.0000000 0.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 4
      -2: X=0.00000000 Y=0.00000000 Z=0.50000000
Nb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  41.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.33333333 Y=0.66666667 Z=0.50100000
          MULT= 4          ISPLIT= 4
      -3: X=0.66666666 Y=0.33333333 Z=0.00100000
      -3: X=0.33333333 Y=0.66666667 Z=0.99900000
      -3: X=0.66666666 Y=0.33333333 Z=0.49900000
Nb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  41.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.33300000 Y=0.00100000 Z=0.13200000
          MULT=12          ISPLIT= 8
      -4: X=0.33200000 Y=0.33300000 Z=0.63200000
      -4: X=0.99900000 Y=0.66700000 Z=0.36800000
      -4: X=0.99900000 Y=0.33200000 Z=0.13200000
      -4: X=0.33200000 Y=0.99900000 Z=0.86800000
      -4: X=0.66700000 Y=0.99900000 Z=0.63200000
      -4: X=0.33300000 Y=0.33200000 Z=0.36800000
      -4: X=0.66800000 Y=0.66700000 Z=0.13200000
      -4: X=0.00100000 Y=0.33300000 Z=0.86800000
      -4: X=0.00100000 Y=0.66800000 Z=0.63200000
      -4: X=0.66800000 Y=0.00100000 Z=0.36800000
      -4: X=0.66700000 Y=0.66800000 Z=0.86800000
S          NPT=  781  R0=.000100000 RMT= 2.10        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000