P   LATTICE,NONEQUIV.ATOMS   5   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 10.098696 10.032556 31.445043 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.48400000 Y=0.25000000 Z=0.63800000
          MULT= 4          ISPLIT= 8
      -1: X=0.51600000 Y=0.75000000 Z=0.36200000
      -1: X=0.98400000 Y=0.25000000 Z=0.86200000
      -1: X=0.01600000 Y=0.75000000 Z=0.13800000
Y          NPT=  781  R0=.000010000 RMT= 2.50000     Z:  39.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.01500000 Y=0.25000000 Z=0.35300000
          MULT= 4          ISPLIT= 8
      -2: X=0.98500000 Y=0.75000000 Z=0.64700000
      -2: X=0.51500000 Y=0.25000000 Z=0.14700000
      -2: X=0.48500000 Y=0.75000000 Z=0.85300000
Y          NPT=  781  R0=.000010000 RMT= 2.50000     Z:  39.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.29500000 Y=0.03800000 Z=0.00300000
          MULT= 8          ISPLIT= 8
      -3: X=0.70500000 Y=0.96200000 Z=0.99700000
      -3: X=0.79500000 Y=0.03800000 Z=0.49700000
      -3: X=0.20500000 Y=0.96200000 Z=0.50300000
      -3: X=0.20500000 Y=0.53800000 Z=0.50300000
      -3: X=0.79500000 Y=0.46200000 Z=0.49700000
      -3: X=0.70500000 Y=0.53800000 Z=0.99700000
      -3: X=0.29500000 Y=0.46200000 Z=0.00300000
P          NPT=  781  R0=.000100000 RMT= 2.09        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.48500000 Y=0.25000000 Z=0.81100000
          MULT= 4          ISPLIT= 8
      -4: X=0.51500000 Y=0.75000000 Z=0.18900000
      -4: X=0.98500000 Y=0.25000000 Z=0.68900000
      -4: X=0.01500000 Y=0.75000000 Z=0.31100000
S          NPT=  781  R0=.000100000 RMT= 2.37        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  -5: X=0.01200000 Y=0.25000000 Z=0.18300000
          MULT= 4          ISPLIT= 8
      -5: X=0.98800000 Y=0.75000000 Z=0.81700000
      -5: X=0.51200000 Y=0.25000000 Z=0.31700000
      -5: X=0.48800000 Y=0.75000000 Z=0.68300000
S          NPT=  781  R0=.000100000 RMT= 2.37        Z:  16.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000