CXZ LATTICE,NONEQUIV.ATOMS   4   15 B2/b                                       
MODE OF CALC=RELA unit=bohr                                                    
 22.047435 12.271882 15.731970 90.000000 90.000000 88.190000                   
ATOM  -1: X=0.65940000 Y=0.26250000 Z=0.33510000
          MULT= 4          ISPLIT= 8
      -1: X=0.34060000 Y=0.73750000 Z=0.66490000
      -1: X=0.34060000 Y=0.23750000 Z=0.33510000
      -1: X=0.65940000 Y=0.76250000 Z=0.66490000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.00000000 Y=0.25000000 Z=0.41480000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.75000000 Z=0.58520000
Ti         NPT=  781  R0=.000050000 RMT= 2.21        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=0.00030000 Z=0.00680000
          MULT= 4          ISPLIT= 8
      -3: X=0.36200000 Y=0.99970000 Z=0.99320000
      -3: X=0.36200000 Y=0.49970000 Z=0.00680000
      -3: X=0.63800000 Y=0.50030000 Z=0.99320000
S          NPT=  781  R0=.000100000 RMT= 1.90        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.00000000 Y=0.25000000 Z=0.15190000
          MULT= 2          ISPLIT= 8
      -4: X=0.00000000 Y=0.75000000 Z=0.84810000
S          NPT=  781  R0=.000100000 RMT= 1.90        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000