CXZ LATTICE,NONEQUIV.ATOMS   4   12 B2/m                                       
MODE OF CALC=RELA unit=bohr                                                    
 25.681378 12.094247  6.746322 90.000000 90.000000 62.400000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 8
Ti         NPT=  781  R0=.000050000 RMT= 2.35        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=0.74400000 Y=0.30600000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -2: X=0.25600000 Y=0.69400000 Z=0.00000000
Ti         NPT=  781  R0=.000050000 RMT= 2.35        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  -3: X=0.63800000 Y=0.02600000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -3: X=0.36200000 Y=0.97400000 Z=0.00000000
Se         NPT=  781  R0=.000050000 RMT= 2.35        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  -4: X=0.88800000 Y=0.45000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -4: X=0.11200000 Y=0.55000000 Z=0.00000000
Se         NPT=  781  R0=.000050000 RMT= 2.35        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000