P   LATTICE,NONEQUIV.ATOMS   5   26 Pmc21                                      
MODE OF CALC=RELA unit=bohr                                                    
  9.585069  8.447832 14.231339 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.50000000 Y=0.25160000 Z=0.50000000
          MULT= 2          ISPLIT= 8
      -1: X=0.50000000 Y=0.74840000 Z=0.00000000
Se         NPT=  781  R0=.000050000 RMT= 1.61        Z:  34.00000              
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=0.12190000 Z=0.12520000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.87810000 Z=0.62520000
Se         NPT=  781  R0=.000050000 RMT= 1.61        Z:  34.00000              
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=0.25400000 Z=0.32800000
          MULT= 2          ISPLIT= 8
      -3: X=0.00000000 Y=0.74600000 Z=0.82800000
O          NPT=  781  R0=.000100000 RMT= 1.46        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.24700000 Y=0.15200000 Z=0.65900000
          MULT= 4          ISPLIT= 8
      -4: X=0.75300000 Y=0.84800000 Z=0.15900000
      -4: X=0.75300000 Y=0.15200000 Z=0.65900000
      -4: X=0.24700000 Y=0.84800000 Z=0.15900000
O          NPT=  781  R0=.000100000 RMT= 1.46        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  -5: X=0.50000000 Y=0.38000000 Z=0.03900000
          MULT= 2          ISPLIT= 8
      -5: X=0.50000000 Y=0.62000000 Z=0.53900000
O          NPT=  781  R0=.000100000 RMT= 1.46        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000