P   LATTICE,NONEQUIV.ATOMS   7   14 P21/n                                      
MODE OF CALC=RELA unit=bohr                                                    
 27.553341 13.589021 13.033441 90.000000 90.000000119.430000                   
ATOM  -1: X=0.42400000 Y=0.01100000 Z=0.63300000
          MULT= 4          ISPLIT= 8
      -1: X=0.57600000 Y=0.98900000 Z=0.36700000
      -1: X=0.07600000 Y=0.48900000 Z=0.13300000
      -1: X=0.92400000 Y=0.51100000 Z=0.86700000
Al         NPT=  781  R0=.000100000 RMT= 1.68        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  -2: X=0.42600000 Y=0.01000000 Z=0.30000000
          MULT= 4          ISPLIT= 8
      -2: X=0.57400000 Y=0.99000000 Z=0.70000000
      -2: X=0.07400000 Y=0.49000000 Z=0.80000000
      -2: X=0.92600000 Y=0.51000000 Z=0.20000000
S          NPT=  781  R0=.000100000 RMT= 1.60        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  -3: X=0.22300000 Y=0.29400000 Z=0.23100000
          MULT= 4          ISPLIT= 8
      -3: X=0.77700000 Y=0.70600000 Z=0.76900000
      -3: X=0.27700000 Y=0.20600000 Z=0.73100000
      -3: X=0.72300000 Y=0.79400000 Z=0.26900000
S          NPT=  781  R0=.000100000 RMT= 1.60        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  -4: X=0.07300000 Y=0.70200000 Z=0.24900000
          MULT= 4          ISPLIT= 8
      -4: X=0.92700000 Y=0.29800000 Z=0.75100000
      -4: X=0.42700000 Y=0.79800000 Z=0.74900000
      -4: X=0.57300000 Y=0.20200000 Z=0.25100000
S          NPT=  781  R0=.000100000 RMT= 1.60        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  -5: X=0.28500000 Y=0.01400000 Z=0.01800000
          MULT= 4          ISPLIT= 8
      -5: X=0.71500000 Y=0.98600000 Z=0.98200000
      -5: X=0.21500000 Y=0.48600000 Z=0.51800000
      -5: X=0.78500000 Y=0.51400000 Z=0.48200000
Na         NPT=  781  R0=.000100000 RMT= 1.43        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=0.38400000 Y=0.53800000 Z=0.48600000
          MULT= 4          ISPLIT= 8
      -6: X=0.61600000 Y=0.46200000 Z=0.51400000
      -6: X=0.11600000 Y=0.96200000 Z=0.98600000
      -6: X=0.88400000 Y=0.03800000 Z=0.01400000
Na         NPT=  781  R0=.000100000 RMT= 1.43        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  -7: X=0.09700000 Y=0.38700000 Z=0.48800000
          MULT= 4          ISPLIT= 8
      -7: X=0.90300000 Y=0.61300000 Z=0.51200000
      -7: X=0.40300000 Y=0.11300000 Z=0.98800000
      -7: X=0.59700000 Y=0.88700000 Z=0.01200000
Na         NPT=  781  R0=.000100000 RMT= 1.43        Z:  11.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000