P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 18.220739 13.564454 23.561105 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.15190000 Y=0.25000000 Z=0.39740000
          MULT= 4          ISPLIT= 8
      -1: X=0.84810000 Y=0.75000000 Z=0.60260000
      -1: X=0.65190000 Y=0.25000000 Z=0.10260000
      -1: X=0.34810000 Y=0.75000000 Z=0.89740000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.47500000 Y=0.25000000 Z=0.68590000
          MULT= 4          ISPLIT= 8
      -2: X=0.52500000 Y=0.75000000 Z=0.31410000
      -2: X=0.97500000 Y=0.25000000 Z=0.81410000
      -2: X=0.02500000 Y=0.75000000 Z=0.18590000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.24180000 Y=0.25000000 Z=0.08030000
          MULT= 4          ISPLIT= 8
      -3: X=0.75820000 Y=0.75000000 Z=0.91970000
      -3: X=0.74180000 Y=0.25000000 Z=0.41970000
      -3: X=0.25820000 Y=0.75000000 Z=0.58030000
Be         NPT=  781  R0=.000100000 RMT= 1.73        Z:   4.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.03660000 Y=0.25000000 Z=0.09990000
          MULT= 4          ISPLIT= 8
      -4: X=0.96340000 Y=0.75000000 Z=0.90010000
      -4: X=0.53660000 Y=0.25000000 Z=0.40010000
      -4: X=0.46340000 Y=0.75000000 Z=0.59990000
Cl         NPT=  781  R0=.000100000 RMT= 2.01        Z:  17.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.30640000 Y=0.25000000 Z=0.92630000
          MULT= 4          ISPLIT= 8
      -5: X=0.69360000 Y=0.75000000 Z=0.07370000
      -5: X=0.80640000 Y=0.25000000 Z=0.57370000
      -5: X=0.19360000 Y=0.75000000 Z=0.42630000
Cl         NPT=  781  R0=.000100000 RMT= 2.01        Z:  17.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.32420000 Y=0.01890000 Z=0.15270000
          MULT= 8          ISPLIT= 8
      -6: X=0.67580000 Y=0.98110000 Z=0.84730000
      -6: X=0.82420000 Y=0.01890000 Z=0.34730000
      -6: X=0.17580000 Y=0.98110000 Z=0.65270000
      -6: X=0.17580000 Y=0.51890000 Z=0.65270000
      -6: X=0.82420000 Y=0.48110000 Z=0.34730000
      -6: X=0.67580000 Y=0.51890000 Z=0.84730000
      -6: X=0.32420000 Y=0.48110000 Z=0.15270000
Cl         NPT=  781  R0=.000100000 RMT= 2.01        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000