P   LATTICE,NONEQUIV.ATOMS   7   33 Pna21                                      
MODE OF CALC=RELA unit=bohr                                                    
 18.780098 12.413611  9.350365 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.13810000 Y=0.52100000 Z=0.24120000
          MULT= 4          ISPLIT= 8
      -1: X=0.86190000 Y=0.47900000 Z=0.74120000
      -1: X=0.36190000 Y=0.02100000 Z=0.74120000
      -1: X=0.63810000 Y=0.97900000 Z=0.24120000
Li         NPT=  781  R0=.000100000 RMT= 1.67        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  -2: X=0.17300000 Y=0.01540000 Z=0.24950000
          MULT= 4          ISPLIT= 8
      -2: X=0.82700000 Y=0.98460000 Z=0.74950000
      -2: X=0.32700000 Y=0.51540000 Z=0.74950000
      -2: X=0.67300000 Y=0.48460000 Z=0.24950000
Al         NPT=  781  R0=.000100000 RMT= 1.66        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  -3: X=0.40670000 Y=0.28030000 Z=0.24980000
          MULT= 4          ISPLIT= 8
      -3: X=0.59330000 Y=0.71970000 Z=0.74980000
      -3: X=0.09330000 Y=0.78030000 Z=0.74980000
      -3: X=0.90670000 Y=0.21970000 Z=0.24980000
Si         NPT=  781  R0=.000100000 RMT= 1.41        Z:  14.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.06630000 Y=0.22630000 Z=0.18460000
          MULT= 4          ISPLIT= 8
      -4: X=0.93370000 Y=0.77370000 Z=0.68460000
      -4: X=0.43370000 Y=0.72630000 Z=0.68460000
      -4: X=0.56630000 Y=0.27370000 Z=0.18460000
O          NPT=  781  R0=.000100000 RMT= 1.63        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  -5: X=0.34080000 Y=0.06820000 Z=0.14320000
          MULT= 4          ISPLIT= 8
      -5: X=0.65920000 Y=0.93180000 Z=0.64320000
      -5: X=0.15920000 Y=0.56820000 Z=0.64320000
      -5: X=0.84080000 Y=0.43180000 Z=0.14320000
O          NPT=  781  R0=.000100000 RMT= 1.63        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=0.33200000 Y=0.46900000 Z=0.10260000
          MULT= 4          ISPLIT= 8
      -6: X=0.66800000 Y=0.53100000 Z=0.60260000
      -6: X=0.16800000 Y=0.96900000 Z=0.60260000
      -6: X=0.83200000 Y=0.03100000 Z=0.10260000
O          NPT=  781  R0=.000100000 RMT= 1.63        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=0.37760000 Y=0.29310000 Z=0.57470000
          MULT= 4          ISPLIT= 8
      -7: X=0.62240000 Y=0.70690000 Z=0.07470000
      -7: X=0.12240000 Y=0.79310000 Z=0.07470000
      -7: X=0.87760000 Y=0.20690000 Z=0.57470000
O          NPT=  781  R0=.000100000 RMT= 1.63        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000