CXY LATTICE,NONEQUIV.ATOMS   2   36 Cmc21                                      
MODE OF CALC=RELA unit=bohr                                                    
 13.214855  9.265327 16.877144 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.55880000 Z=0.38450000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.44120000 Z=0.88450000
I          NPT=  781  R0=.000010000 RMT= 2.43        Z:  53.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.00000000 Y=0.14320000 Z=0.11460000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.85680000 Z=0.61460000
Br         NPT=  781  R0=.000050000 RMT= 2.31        Z:  35.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000