H   LATTICE,NONEQUIV.ATOMS   5  150 P321                                       
MODE OF CALC=RELA unit=bohr                                                    
 14.847578 14.847578 18.237747 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=0.67600000
          MULT= 2          ISPLIT= 4
      -2: X=0.66666667 Y=0.33333333 Z=0.32400000
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=0.18600000
          MULT= 2          ISPLIT= 4
      -3: X=0.66666667 Y=0.33333333 Z=0.81400000
Bi         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  83.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.47000000 Y=0.00000000 Z=0.00000000
          MULT= 3          ISPLIT= 8
      -4: X=0.00000000 Y=0.47000000 Z=0.00000000
      -4: X=0.53000000 Y=0.53000000 Z=0.00000000
Cl         NPT=  781  R0=.000100000 RMT= 2.11        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=0.20500000 Y=0.35700000 Z=0.32200000
          MULT= 6          ISPLIT= 8
      -5: X=0.64300000 Y=0.84800000 Z=0.32200000
      -5: X=0.35700000 Y=0.20500000 Z=0.67800000
      -5: X=0.15200000 Y=0.79500000 Z=0.32200000
      -5: X=0.79500000 Y=0.15200000 Z=0.67800000
      -5: X=0.84800000 Y=0.64300000 Z=0.67800000
Cl         NPT=  781  R0=.000100000 RMT= 2.11        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000