P   LATTICE,NONEQUIV.ATOMS   9   11 P21/m                                      
MODE OF CALC=RELA unit=bohr                                                    
 15.476857 14.588686 25.681378 90.000000 90.000000118.000000                   
ATOM  -1: X=0.41680000 Y=0.60810000 Z=0.07510000
          MULT= 4          ISPLIT= 8
      -1: X=0.58320000 Y=0.39190000 Z=0.92490000
      -1: X=0.58320000 Y=0.39190000 Z=0.57510000
      -1: X=0.41680000 Y=0.60810000 Z=0.42490000
Na         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  11.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.11760000 Y=0.69200000 Z=0.57770000
          MULT= 4          ISPLIT= 8
      -2: X=0.88240000 Y=0.30800000 Z=0.42230000
      -2: X=0.88240000 Y=0.30800000 Z=0.07770000
      -2: X=0.11760000 Y=0.69200000 Z=0.92230000
Na         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  11.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.73810000 Y=0.94040000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -3: X=0.26190000 Y=0.05960000 Z=0.75000000
Na         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  11.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.14420000 Y=0.72910000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -4: X=0.85580000 Y=0.27090000 Z=0.75000000
Na         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  11.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.59530000 Y=0.40120000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -5: X=0.40470000 Y=0.59880000 Z=0.75000000
Na         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  11.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.16190000 Y=0.08640000 Z=0.08960000
          MULT= 4          ISPLIT= 8
      -6: X=0.83810000 Y=0.91360000 Z=0.91040000
      -6: X=0.83810000 Y=0.91360000 Z=0.58960000
      -6: X=0.16190000 Y=0.08640000 Z=0.41040000
Al         NPT=  781  R0=.000100000 RMT= 2.36        Z:  13.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.14940000 Y=0.27420000 Z=0.57840000
          MULT= 4          ISPLIT= 8
      -7: X=0.85060000 Y=0.72580000 Z=0.42160000
      -7: X=0.85060000 Y=0.72580000 Z=0.07840000
      -7: X=0.14940000 Y=0.27420000 Z=0.92160000
Sb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  51.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.46370000 Y=0.02890000 Z=0.10150000
          MULT= 4          ISPLIT= 8
      -8: X=0.53630000 Y=0.97110000 Z=0.89850000
      -8: X=0.53630000 Y=0.97110000 Z=0.60150000
      -8: X=0.46370000 Y=0.02890000 Z=0.39850000
Sb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  51.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -9: X=0.16260000 Y=0.29910000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -9: X=0.83740000 Y=0.70090000 Z=0.75000000
Sb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  51.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000