H   LATTICE,NONEQUIV.ATOMS   5  150 P321                                       
MODE OF CALC=RELA unit=bohr                                                    
 13.927282 13.927282 16.837460 90.000000 90.000000120.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 4
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.33333333 Y=0.66666667 Z=0.68000000
          MULT= 2          ISPLIT= 4
      -2: X=0.66666667 Y=0.33333333 Z=0.32000000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.33333333 Y=0.66666667 Z=0.19500000
          MULT= 2          ISPLIT= 4
      -3: X=0.66666667 Y=0.33333333 Z=0.80500000
As         NPT=  781  R0=.000050000 RMT= 2.22        Z:  33.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.48000000 Y=0.00000000 Z=0.00000000
          MULT= 3          ISPLIT= 8
      -4: X=0.00000000 Y=0.48000000 Z=0.00000000
      -4: X=0.52000000 Y=0.52000000 Z=0.00000000
Cl         NPT=  781  R0=.000100000 RMT= 2.01        Z:  17.00000              
LOCAL ROT MATRIX:    0.0000000-0.5000000 0.8660254
                     0.0000000-0.8660254-0.5000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.20000000 Y=0.36500000 Z=0.32500000
          MULT= 6          ISPLIT= 8
      -5: X=0.63500000 Y=0.83500000 Z=0.32500000
      -5: X=0.36500000 Y=0.20000000 Z=0.67500000
      -5: X=0.16500000 Y=0.80000000 Z=0.32500000
      -5: X=0.80000000 Y=0.16500000 Z=0.67500000
      -5: X=0.83500000 Y=0.63500000 Z=0.67500000
Cl         NPT=  781  R0=.000100000 RMT= 2.01        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000