P   LATTICE,NONEQUIV.ATOMS   5   57 Pbcm                                       
MODE OF CALC=RELA unit=bohr                                                    
 20.214400 15.038441 13.742088 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.39600000 Y=0.25000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.60400000 Y=0.75000000 Z=0.00000000
      -1: X=0.39600000 Y=0.25000000 Z=0.50000000
      -1: X=0.60400000 Y=0.75000000 Z=0.50000000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.11000000 Y=0.45300000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -2: X=0.89000000 Y=0.54700000 Z=0.75000000
      -2: X=0.89000000 Y=0.95300000 Z=0.25000000
      -2: X=0.11000000 Y=0.04700000 Z=0.75000000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.71280000 Y=0.33730000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -3: X=0.28720000 Y=0.66270000 Z=0.75000000
      -3: X=0.28720000 Y=0.83730000 Z=0.25000000
      -3: X=0.71280000 Y=0.16270000 Z=0.75000000
Hg         NPT=  781  R0=.000005000 RMT= 2.43        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  -4: X=0.60690000 Y=0.08100000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -4: X=0.39310000 Y=0.91900000 Z=0.75000000
      -4: X=0.39310000 Y=0.58100000 Z=0.25000000
      -4: X=0.60690000 Y=0.41900000 Z=0.75000000
S          NPT=  781  R0=.000100000 RMT= 1.89        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=0.16420000 Y=0.07500000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -5: X=0.83580000 Y=0.92500000 Z=0.75000000
      -5: X=0.83580000 Y=0.57500000 Z=0.25000000
      -5: X=0.16420000 Y=0.42500000 Z=0.75000000
S          NPT=  781  R0=.000100000 RMT= 1.89        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000