P   LATTICE,NONEQUIV.ATOMS   4   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 12.597292 17.813125 12.615812 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00500000 Y=0.25000000 Z=0.03740000
          MULT= 4          ISPLIT= 8
      -1: X=0.99500000 Y=0.75000000 Z=0.96260000
      -1: X=0.50500000 Y=0.25000000 Z=0.46260000
      -1: X=0.49500000 Y=0.75000000 Z=0.53740000
Ca         NPT=  781  R0=.000050000 RMT= 2.21        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=0.24500000 Y=0.51350000 Z=0.25600000
          MULT= 8          ISPLIT= 8
      -2: X=0.75500000 Y=0.48650000 Z=0.74400000
      -2: X=0.74500000 Y=0.51350000 Z=0.24400000
      -2: X=0.25500000 Y=0.48650000 Z=0.75600000
      -2: X=0.25500000 Y=0.01350000 Z=0.75600000
      -2: X=0.74500000 Y=0.98650000 Z=0.24400000
      -2: X=0.75500000 Y=0.01350000 Z=0.74400000
      -2: X=0.24500000 Y=0.98650000 Z=0.25600000
Ca         NPT=  781  R0=.000050000 RMT= 2.21        Z:  20.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.01600000 Y=0.25000000 Z=0.50600000
          MULT= 4          ISPLIT= 8
      -3: X=0.98400000 Y=0.75000000 Z=0.49400000
      -3: X=0.51600000 Y=0.25000000 Z=0.99400000
      -3: X=0.48400000 Y=0.75000000 Z=0.00600000
Si         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  14.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -4: X=0.50000000 Y=0.00000000 Z=0.50000000
      -4: X=0.50000000 Y=0.50000000 Z=0.50000000
      -4: X=0.00000000 Y=0.50000000 Z=0.00000000
O          NPT=  781  R0=.000100000 RMT= 2.21        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000