CXY LATTICE,NONEQUIV.ATOMS   6   64 Cmca                                       
MODE OF CALC=RELA unit=bohr                                                    
 11.538668 20.748059 15.883148 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.33471000 Z=0.11963000
          MULT= 4          ISPLIT= 8
      -1: X=0.00000000 Y=0.66529000 Z=0.88037000
      -1: X=0.00000000 Y=0.83471000 Z=0.38037000
      -1: X=0.00000000 Y=0.16529000 Z=0.61963000
Si         NPT=  781  R0=.000100000 RMT= 1.89        Z:  14.00000              
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=0.17650000 Z=0.34070000
          MULT= 4          ISPLIT= 8
      -2: X=0.00000000 Y=0.82350000 Z=0.65930000
      -2: X=0.00000000 Y=0.67650000 Z=0.15930000
      -2: X=0.00000000 Y=0.32350000 Z=0.84070000
Li         NPT=  781  R0=.000100000 RMT= 2.12        Z:   3.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.00000000 Y=0.39938000 Z=0.34849000
          MULT= 4          ISPLIT= 8
      -3: X=0.00000000 Y=0.60062000 Z=0.65151000
      -3: X=0.00000000 Y=0.89938000 Z=0.15151000
      -3: X=0.00000000 Y=0.10062000 Z=0.84849000
B          NPT=  781  R0=.000100000 RMT= 1.66        Z:   5.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.00000000 Y=0.15250000 Z=0.05632000
          MULT= 4          ISPLIT= 8
      -4: X=0.00000000 Y=0.84750000 Z=0.94368000
      -4: X=0.00000000 Y=0.65250000 Z=0.44368000
      -4: X=0.00000000 Y=0.34750000 Z=0.55632000
B          NPT=  781  R0=.000100000 RMT= 1.66        Z:   5.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -5: X=0.26543000 Y=0.42066000 Z=0.03192000
          MULT= 8          ISPLIT= 8
      -5: X=0.73457000 Y=0.57934000 Z=0.96808000
      -5: X=0.26543000 Y=0.92066000 Z=0.46808000
      -5: X=0.73457000 Y=0.07934000 Z=0.53192000
      -5: X=0.73457000 Y=0.42066000 Z=0.03192000
      -5: X=0.26543000 Y=0.57934000 Z=0.96808000
      -5: X=0.73457000 Y=0.92066000 Z=0.46808000
      -5: X=0.26543000 Y=0.07934000 Z=0.53192000
B          NPT=  781  R0=.000100000 RMT= 1.66        Z:   5.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.15875000 Y=0.03954000 Z=0.16625000
          MULT= 8          ISPLIT= 8
      -6: X=0.84125000 Y=0.96046000 Z=0.83375000
      -6: X=0.15875000 Y=0.53954000 Z=0.33375000
      -6: X=0.84125000 Y=0.46046000 Z=0.66625000
      -6: X=0.84125000 Y=0.03954000 Z=0.16625000
      -6: X=0.15875000 Y=0.96046000 Z=0.83375000
      -6: X=0.84125000 Y=0.53954000 Z=0.33375000
      -6: X=0.15875000 Y=0.46046000 Z=0.66625000
B          NPT=  781  R0=.000100000 RMT= 1.66        Z:   5.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000