P   LATTICE,NONEQUIV.ATOMS   5   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 18.713580 11.604808 14.665787 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.15400000 Y=0.25000000 Z=0.65820000
          MULT= 4          ISPLIT= 8
      -1: X=0.84600000 Y=0.75000000 Z=0.34180000
      -1: X=0.65400000 Y=0.25000000 Z=0.84180000
      -1: X=0.34600000 Y=0.75000000 Z=0.15820000
Rb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  37.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.09580000 Y=0.25000000 Z=0.16040000
          MULT= 4          ISPLIT= 8
      -2: X=0.90420000 Y=0.75000000 Z=0.83960000
      -2: X=0.59580000 Y=0.25000000 Z=0.33960000
      -2: X=0.40420000 Y=0.75000000 Z=0.66040000
S          NPT=  781  R0=.000100000 RMT= 1.39        Z:  16.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.14950000 Y=0.05590000 Z=0.01860000
          MULT= 8          ISPLIT= 8
      -3: X=0.85050000 Y=0.94410000 Z=0.98140000
      -3: X=0.64950000 Y=0.05590000 Z=0.48140000
      -3: X=0.35050000 Y=0.94410000 Z=0.51860000
      -3: X=0.35050000 Y=0.55590000 Z=0.51860000
      -3: X=0.64950000 Y=0.44410000 Z=0.48140000
      -3: X=0.85050000 Y=0.55590000 Z=0.98140000
      -3: X=0.14950000 Y=0.44410000 Z=0.01860000
F          NPT=  781  R0=.000100000 RMT= 1.54        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.07170000 Y=0.04630000 Z=0.31100000
          MULT= 8          ISPLIT= 8
      -4: X=0.92830000 Y=0.95370000 Z=0.68900000
      -4: X=0.57170000 Y=0.04630000 Z=0.18900000
      -4: X=0.42830000 Y=0.95370000 Z=0.81100000
      -4: X=0.42830000 Y=0.54630000 Z=0.81100000
      -4: X=0.57170000 Y=0.45370000 Z=0.18900000
      -4: X=0.92830000 Y=0.54630000 Z=0.68900000
      -4: X=0.07170000 Y=0.45370000 Z=0.31100000
F          NPT=  781  R0=.000100000 RMT= 1.54        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.24270000 Y=0.25000000 Z=0.23260000
          MULT= 4          ISPLIT= 8
      -5: X=0.75730000 Y=0.75000000 Z=0.76740000
      -5: X=0.74270000 Y=0.25000000 Z=0.26740000
      -5: X=0.25730000 Y=0.75000000 Z=0.73260000
F          NPT=  781  R0=.000100000 RMT= 1.54        Z:   9.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000