P   LATTICE,NONEQUIV.ATOMS   7   59 Pmmn                                       
MODE OF CALC=RELA unit=bohr                                                    
 10.270662 14.360029 16.890372 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.25000000 Y=0.75000000 Z=0.95667000
          MULT= 2          ISPLIT= 8
      -1: X=0.75000000 Y=0.25000000 Z=0.04333000
As         NPT=  781  R0=.000050000 RMT= 1.66        Z:  33.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.25000000 Y=0.04103000 Z=0.26020000
          MULT= 4          ISPLIT= 8
      -2: X=0.75000000 Y=0.95897000 Z=0.73980000
      -2: X=0.75000000 Y=0.54103000 Z=0.73980000
      -2: X=0.25000000 Y=0.45897000 Z=0.26020000
Mo         NPT=  781  R0=.000010000 RMT= 1.67        Z:  42.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.25000000 Y=0.25000000 Z=0.60400000
          MULT= 2          ISPLIT= 8
      -3: X=0.75000000 Y=0.75000000 Z=0.39600000
Li         NPT=  781  R0=.000100000 RMT= 1.65        Z:   3.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.25000000 Y=0.56320000 Z=0.05860000
          MULT= 4          ISPLIT= 8
      -4: X=0.75000000 Y=0.43680000 Z=0.94140000
      -4: X=0.75000000 Y=0.06320000 Z=0.94140000
      -4: X=0.25000000 Y=0.93680000 Z=0.05860000
O          NPT=  781  R0=.000100000 RMT= 1.50        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -5: X=0.25000000 Y=0.25000000 Z=0.38500000
          MULT= 2          ISPLIT= 8
      -5: X=0.75000000 Y=0.75000000 Z=0.61500000
O          NPT=  781  R0=.000100000 RMT= 1.50        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  -6: X=0.00840000 Y=0.25000000 Z=0.14690000
          MULT= 4          ISPLIT= 8
      -6: X=0.99160000 Y=0.75000000 Z=0.85310000
      -6: X=0.50840000 Y=0.75000000 Z=0.85310000
      -6: X=0.49160000 Y=0.25000000 Z=0.14690000
O          NPT=  781  R0=.000100000 RMT= 1.50        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  -7: X=0.00610000 Y=0.56820000 Z=0.33260000
          MULT= 8          ISPLIT= 8
      -7: X=0.99390000 Y=0.43180000 Z=0.66740000
      -7: X=0.50610000 Y=0.06820000 Z=0.66740000
      -7: X=0.49390000 Y=0.93180000 Z=0.33260000
      -7: X=0.49390000 Y=0.56820000 Z=0.33260000
      -7: X=0.50610000 Y=0.43180000 Z=0.66740000
      -7: X=0.99390000 Y=0.06820000 Z=0.66740000
      -7: X=0.00610000 Y=0.93180000 Z=0.33260000
O          NPT=  781  R0=.000100000 RMT= 1.50        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000