P   LATTICE,NONEQUIV.ATOMS  10    4 P21                                        
MODE OF CALC=RELA unit=bohr                                                    
 18.432389 12.481641 14.458484 90.000000 90.000000 92.110000                   
ATOM  -1: X=0.01801000 Y=0.18260000 Z=0.23217000
          MULT= 2          ISPLIT= 8
      -1: X=0.98199000 Y=0.81740000 Z=0.73217000
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  -2: X=0.50699000 Y=0.69550000 Z=0.44662000
          MULT= 2          ISPLIT= 8
      -2: X=0.49301000 Y=0.30450000 Z=0.94662000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.17345000 Y=0.30775000 Z=0.65081000
          MULT= 2          ISPLIT= 8
      -3: X=0.82655000 Y=0.69225000 Z=0.15081000
P          NPT=  781  R0=.000100000 RMT= 1.80        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=0.30390000 Y=0.20431000 Z=0.43218000
          MULT= 2          ISPLIT= 8
      -4: X=0.69610000 Y=0.79569000 Z=0.93218000
P          NPT=  781  R0=.000100000 RMT= 1.80        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  -5: X=0.01839000 Y=0.67156000 Z=0.03582000
          MULT= 2          ISPLIT= 8
      -5: X=0.98161000 Y=0.32844000 Z=0.53582000
S          NPT=  781  R0=.000100000 RMT= 1.89        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.17247000 Y=0.08904000 Z=0.84077000
          MULT= 2          ISPLIT= 8
      -6: X=0.82753000 Y=0.91096000 Z=0.34077000
S          NPT=  781  R0=.000100000 RMT= 1.89        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.74772000 Y=0.42846000 Z=0.23744000
          MULT= 2          ISPLIT= 8
      -7: X=0.25228000 Y=0.57154000 Z=0.73744000
S          NPT=  781  R0=.000100000 RMT= 1.89        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.19377000 Y=0.94531000 Z=0.35624000
          MULT= 2          ISPLIT= 8
      -8: X=0.80623000 Y=0.05469000 Z=0.85624000
S          NPT=  781  R0=.000100000 RMT= 1.89        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -9: X=0.26932000 Y=0.41219000 Z=0.24545000
          MULT= 2          ISPLIT= 8
      -9: X=0.73068000 Y=0.58781000 Z=0.74545000
S          NPT=  781  R0=.000100000 RMT= 1.89        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM -10: X=0.49216000 Y=0.17287000 Z=0.51565000
          MULT= 2          ISPLIT= 8
     -10: X=0.50784000 Y=0.82713000 Z=0.01565000
S          NPT=  781  R0=.000100000 RMT= 1.89        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000