CXY LATTICE,NONEQUIV.ATOMS   9   65 Cmmm                                       
MODE OF CALC=RELA unit=bohr                                                    
  5.922591 62.665208  6.128004 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.50000000 Y=0.00000000 Z=0.50000000
          MULT= 1          ISPLIT= 8
Nb         NPT=  781  R0=.000010000 RMT= 2.22        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  -2: X=0.00000000 Y=0.36950000 Z=0.50000000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.63050000 Z=0.50000000
Nb         NPT=  781  R0=.000010000 RMT= 2.22        Z:  41.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.00000000 Y=0.06736000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -3: X=0.00000000 Y=0.93264000 Z=0.00000000
Nb         NPT=  781  R0=.000010000 RMT= 2.22        Z:  41.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.00000000 Y=0.20942000 Z=0.50000000
          MULT= 2          ISPLIT= 8
      -4: X=0.00000000 Y=0.79058000 Z=0.50000000
Nb         NPT=  781  R0=.000010000 RMT= 2.22        Z:  41.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 8
C          NPT=  781  R0=.000100000 RMT= 1.82        Z:   6.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.00000000 Y=0.43430000 Z=0.50000000
          MULT= 2          ISPLIT= 8
      -6: X=0.00000000 Y=0.56570000 Z=0.50000000
C          NPT=  781  R0=.000100000 RMT= 1.82        Z:   6.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -7: X=0.00000000 Y=0.31860000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -7: X=0.00000000 Y=0.68140000 Z=0.00000000
B          NPT=  781  R0=.000100000 RMT= 1.69        Z:   5.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -8: X=0.00000000 Y=0.26340000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -8: X=0.00000000 Y=0.73660000 Z=0.00000000
B          NPT=  781  R0=.000100000 RMT= 1.69        Z:   5.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -9: X=0.00000000 Y=0.15200000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -9: X=0.00000000 Y=0.84800000 Z=0.00000000
B          NPT=  781  R0=.000100000 RMT= 1.69        Z:   5.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000