R   LATTICE,NONEQUIV.ATOMS   3  167 R-3c                                       
MODE OF CALC=RELA unit=bohr                                                    
 15.903935 15.903935 41.413346 90.000000 90.000000120.000000                   
ATOM  -1: X=0.09225000 Y=0.09225000 Z=0.09225000
          MULT= 4          ISPLIT= 4
      -1: X=0.90775000 Y=0.90775000 Z=0.90775000
      -1: X=0.59225000 Y=0.59225000 Z=0.59225000
      -1: X=0.40775000 Y=0.40775000 Z=0.40775000
Sr         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  38.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.36331000 Y=0.70736000 Z=0.97892000
          MULT=12          ISPLIT= 8
      -2: X=0.63669000 Y=0.29264000 Z=0.02108000
      -2: X=0.70736000 Y=0.97892000 Z=0.36331000
      -2: X=0.29264000 Y=0.02108000 Z=0.63669000
      -2: X=0.86331000 Y=0.47892000 Z=0.20736000
      -2: X=0.13669000 Y=0.52108000 Z=0.79264000
      -2: X=0.97892000 Y=0.36331000 Z=0.70736000
      -2: X=0.02108000 Y=0.63669000 Z=0.29264000
      -2: X=0.47892000 Y=0.20736000 Z=0.86331000
      -2: X=0.52108000 Y=0.79264000 Z=0.13669000
      -2: X=0.20736000 Y=0.86331000 Z=0.47892000
      -2: X=0.79264000 Y=0.13669000 Z=0.52108000
Au         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  79.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.44283000 Y=0.05717000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -3: X=0.55717000 Y=0.94283000 Z=0.75000000
      -3: X=0.05717000 Y=0.25000000 Z=0.44283000
      -3: X=0.94283000 Y=0.75000000 Z=0.55717000
      -3: X=0.25000000 Y=0.44283000 Z=0.05717000
      -3: X=0.75000000 Y=0.55717000 Z=0.94283000
Zn         NPT=  781  R0=.000050000 RMT= 2.39        Z:  30.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000