P   LATTICE,NONEQUIV.ATOMS   8   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 28.299216 10.062981 13.771379 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.47724000 Y=0.25000000 Z=0.88364000
          MULT= 4          ISPLIT= 8
      -1: X=0.52276000 Y=0.75000000 Z=0.11636000
      -1: X=0.97724000 Y=0.25000000 Z=0.61636000
      -1: X=0.02276000 Y=0.75000000 Z=0.38364000
Se         NPT=  781  R0=.000050000 RMT= 1.67        Z:  34.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.27437000 Y=0.25000000 Z=0.00504000
          MULT= 4          ISPLIT= 8
      -2: X=0.72563000 Y=0.75000000 Z=0.99496000
      -2: X=0.77437000 Y=0.25000000 Z=0.49496000
      -2: X=0.22563000 Y=0.75000000 Z=0.50504000
Se         NPT=  781  R0=.000050000 RMT= 1.67        Z:  34.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.12781000 Y=0.25000000 Z=0.30866000
          MULT= 4          ISPLIT= 8
      -3: X=0.87219000 Y=0.75000000 Z=0.69134000
      -3: X=0.62781000 Y=0.25000000 Z=0.19134000
      -3: X=0.37219000 Y=0.75000000 Z=0.80866000
Ga         NPT=  781  R0=.000050000 RMT= 1.93        Z:  31.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.38936000 Y=0.25000000 Z=0.42558000
          MULT= 4          ISPLIT= 8
      -4: X=0.61064000 Y=0.75000000 Z=0.57442000
      -4: X=0.88936000 Y=0.25000000 Z=0.07442000
      -4: X=0.11064000 Y=0.75000000 Z=0.92558000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.08834000 Y=0.25000000 Z=0.57040000
          MULT= 4          ISPLIT= 8
      -5: X=0.91166000 Y=0.75000000 Z=0.42960000
      -5: X=0.58834000 Y=0.25000000 Z=0.92960000
      -5: X=0.41166000 Y=0.75000000 Z=0.07040000
O          NPT=  781  R0=.000100000 RMT= 1.51        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.03333000 Y=0.50290000 Z=0.23910000
          MULT= 8          ISPLIT= 8
      -6: X=0.96667000 Y=0.49710000 Z=0.76090000
      -6: X=0.53333000 Y=0.50290000 Z=0.26090000
      -6: X=0.46667000 Y=0.49710000 Z=0.73910000
      -6: X=0.46667000 Y=0.00290000 Z=0.73910000
      -6: X=0.53333000 Y=0.99710000 Z=0.26090000
      -6: X=0.96667000 Y=0.00290000 Z=0.76090000
      -6: X=0.03333000 Y=0.99710000 Z=0.23910000
O          NPT=  781  R0=.000100000 RMT= 1.51        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.16297000 Y=0.25000000 Z=0.05020000
          MULT= 4          ISPLIT= 8
      -7: X=0.83703000 Y=0.75000000 Z=0.94980000
      -7: X=0.66297000 Y=0.25000000 Z=0.44980000
      -7: X=0.33703000 Y=0.75000000 Z=0.55020000
O          NPT=  781  R0=.000100000 RMT= 1.51        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -8: X=0.22026000 Y=0.50580000 Z=0.35670000
          MULT= 8          ISPLIT= 8
      -8: X=0.77974000 Y=0.49420000 Z=0.64330000
      -8: X=0.72026000 Y=0.50580000 Z=0.14330000
      -8: X=0.27974000 Y=0.49420000 Z=0.85670000
      -8: X=0.27974000 Y=0.00580000 Z=0.85670000
      -8: X=0.72026000 Y=0.99420000 Z=0.14330000
      -8: X=0.77974000 Y=0.00580000 Z=0.64330000
      -8: X=0.22026000 Y=0.99420000 Z=0.35670000
O          NPT=  781  R0=.000100000 RMT= 1.51        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000