P   LATTICE,NONEQUIV.ATOMS   4  130 P4/ncc                                     
MODE OF CALC=RELA unit=bohr                                                    
 16.384492 16.384492 11.395238 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.40799000 Y=0.59201000 Z=0.25000000
          MULT= 8          ISPLIT= 8
      -1: X=0.59201000 Y=0.40799000 Z=0.75000000
      -1: X=0.90799000 Y=0.40799000 Z=0.25000000
      -1: X=0.09201000 Y=0.59201000 Z=0.75000000
      -1: X=0.09201000 Y=0.90799000 Z=0.25000000
      -1: X=0.90799000 Y=0.09201000 Z=0.75000000
      -1: X=0.59201000 Y=0.09201000 Z=0.25000000
      -1: X=0.40799000 Y=0.90799000 Z=0.75000000
Bi         NPT=  781  R0=.000005000 RMT= 2.41        Z:  83.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068-0.7071068
                     0.0000000-0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.25000000 Y=0.25000000 Z=0.08610000
          MULT= 4          ISPLIT=-2
      -2: X=0.75000000 Y=0.75000000 Z=0.91390000
      -2: X=0.25000000 Y=0.25000000 Z=0.58610000
      -2: X=0.75000000 Y=0.75000000 Z=0.41390000
Au         NPT=  781  R0=.000005000 RMT= 2.07        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=0.04200000 Y=0.14900000 Z=0.09500000
          MULT=16          ISPLIT= 8
      -3: X=0.95800000 Y=0.85100000 Z=0.90500000
      -3: X=0.35100000 Y=0.04200000 Z=0.09500000
      -3: X=0.64900000 Y=0.95800000 Z=0.90500000
      -3: X=0.45800000 Y=0.14900000 Z=0.59500000
      -3: X=0.54200000 Y=0.85100000 Z=0.40500000
      -3: X=0.45800000 Y=0.35100000 Z=0.09500000
      -3: X=0.54200000 Y=0.64900000 Z=0.90500000
      -3: X=0.35100000 Y=0.45800000 Z=0.59500000
      -3: X=0.64900000 Y=0.54200000 Z=0.40500000
      -3: X=0.14900000 Y=0.45800000 Z=0.09500000
      -3: X=0.85100000 Y=0.54200000 Z=0.90500000
      -3: X=0.04200000 Y=0.35100000 Z=0.59500000
      -3: X=0.95800000 Y=0.64900000 Z=0.40500000
      -3: X=0.14900000 Y=0.04200000 Z=0.59500000
      -3: X=0.85100000 Y=0.95800000 Z=0.40500000
O          NPT=  781  R0=.000100000 RMT= 1.70        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.75000000 Y=0.25000000 Z=0.00000000
          MULT= 4          ISPLIT=-2
      -4: X=0.25000000 Y=0.75000000 Z=0.00000000
      -4: X=0.75000000 Y=0.25000000 Z=0.50000000
      -4: X=0.25000000 Y=0.75000000 Z=0.50000000
O          NPT=  781  R0=.000100000 RMT= 1.70        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000