P   LATTICE,NONEQUIV.ATOMS   3   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 14.853247  9.240761 18.651597 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.03800000 Y=0.25000000 Z=0.71800000
          MULT= 4          ISPLIT= 8
      -1: X=0.96200000 Y=0.75000000 Z=0.28200000
      -1: X=0.53800000 Y=0.25000000 Z=0.78200000
      -1: X=0.46200000 Y=0.75000000 Z=0.21800000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.17400000 Y=0.25000000 Z=0.06200000
          MULT= 4          ISPLIT= 8
      -2: X=0.82600000 Y=0.75000000 Z=0.93800000
      -2: X=0.67400000 Y=0.25000000 Z=0.43800000
      -2: X=0.32600000 Y=0.75000000 Z=0.56200000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.20200000 Y=0.25000000 Z=0.38900000
          MULT= 4          ISPLIT= 8
      -3: X=0.79800000 Y=0.75000000 Z=0.61100000
      -3: X=0.70200000 Y=0.25000000 Z=0.11100000
      -3: X=0.29800000 Y=0.75000000 Z=0.88900000
Hg         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  80.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000