P   LATTICE,NONEQUIV.ATOMS   6  102 P42nm                                      
MODE OF CALC=RELA unit=bohr                                                    
 26.575219 26.575219  7.917008 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.15251000 Y=0.57410000 Z=0.22339000
          MULT= 8          ISPLIT= 8
      -1: X=0.92590000 Y=0.65251000 Z=0.72339000
      -1: X=0.34749000 Y=0.07410000 Z=0.72339000
      -1: X=0.84749000 Y=0.42590000 Z=0.22339000
      -1: X=0.42590000 Y=0.84749000 Z=0.22339000
      -1: X=0.07410000 Y=0.34749000 Z=0.72339000
      -1: X=0.65251000 Y=0.92590000 Z=0.72339000
      -1: X=0.57410000 Y=0.15251000 Z=0.22339000
Hg         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  80.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.09922000 Y=0.09922000 Z=0.31620000
          MULT= 4          ISPLIT= 8
      -2: X=0.40078000 Y=0.59922000 Z=0.81620000
      -2: X=0.90078000 Y=0.90078000 Z=0.31620000
      -2: X=0.59922000 Y=0.40078000 Z=0.81620000
Hg         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  80.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068-0.7071068
                     0.0000000-0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.33108000 Y=0.33108000 Z=0.21490000
          MULT= 4          ISPLIT= 8
      -3: X=0.16892000 Y=0.83108000 Z=0.71490000
      -3: X=0.66892000 Y=0.66892000 Z=0.21490000
      -3: X=0.83108000 Y=0.16892000 Z=0.71490000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068-0.7071068
                     0.0000000-0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.02070000 Y=0.69200000 Z=0.22200000
          MULT= 8          ISPLIT= 8
      -4: X=0.80800000 Y=0.52070000 Z=0.72200000
      -4: X=0.47930000 Y=0.19200000 Z=0.72200000
      -4: X=0.97930000 Y=0.30800000 Z=0.22200000
      -4: X=0.30800000 Y=0.97930000 Z=0.22200000
      -4: X=0.19200000 Y=0.47930000 Z=0.72200000
      -4: X=0.52070000 Y=0.80800000 Z=0.72200000
      -4: X=0.69200000 Y=0.02070000 Z=0.22200000
S          NPT=  781  R0=.000100000 RMT= 1.95        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -5: X=0.50000000 Y=0.50000000 Z=0.50000000
S          NPT=  781  R0=.000100000 RMT= 1.95        Z:  16.00000              
LOCAL ROT MATRIX:    0.7071068 0.7071068 0.0000000
                    -0.7071068 0.7071068 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.18280000 Y=0.18280000 Z=0.71870000
          MULT= 4          ISPLIT= 8
      -6: X=0.31720000 Y=0.68280000 Z=0.21870000
      -6: X=0.81720000 Y=0.81720000 Z=0.71870000
      -6: X=0.68280000 Y=0.31720000 Z=0.21870000
S          NPT=  781  R0=.000100000 RMT= 1.95        Z:  16.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068-0.7071068
                     0.0000000-0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000