P   LATTICE,NONEQUIV.ATOMS   6   52 Pnna                                       
MODE OF CALC=RELA unit=bohr                                                    
 12.466523 27.952829 20.010310 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.30830000 Y=0.25000000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -1: X=0.69170000 Y=0.75000000 Z=0.75000000
      -1: X=0.80830000 Y=0.25000000 Z=0.75000000
      -1: X=0.19170000 Y=0.75000000 Z=0.25000000
Ga         NPT=  781  R0=.000050000 RMT= 2.30        Z:  31.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.40250000 Y=0.28340000 Z=0.61110000
          MULT= 8          ISPLIT= 8
      -2: X=0.59750000 Y=0.71660000 Z=0.38890000
      -2: X=0.90250000 Y=0.28340000 Z=0.38890000
      -2: X=0.09750000 Y=0.71660000 Z=0.61110000
      -2: X=0.59750000 Y=0.78340000 Z=0.11110000
      -2: X=0.40250000 Y=0.21660000 Z=0.88890000
      -2: X=0.09750000 Y=0.78340000 Z=0.88890000
      -2: X=0.90250000 Y=0.21660000 Z=0.11110000
Ga         NPT=  781  R0=.000050000 RMT= 2.30        Z:  31.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.05930000 Y=0.09230000 Z=0.62020000
          MULT= 8          ISPLIT= 8
      -3: X=0.94070000 Y=0.90770000 Z=0.37980000
      -3: X=0.55930000 Y=0.09230000 Z=0.37980000
      -3: X=0.44070000 Y=0.90770000 Z=0.62020000
      -3: X=0.94070000 Y=0.59230000 Z=0.12020000
      -3: X=0.05930000 Y=0.40770000 Z=0.87980000
      -3: X=0.44070000 Y=0.59230000 Z=0.87980000
      -3: X=0.55930000 Y=0.40770000 Z=0.12020000
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  -4: X=0.25000000 Y=0.00000000 Z=0.07810000
          MULT= 4          ISPLIT= 8
      -4: X=0.75000000 Y=0.00000000 Z=0.92190000
      -4: X=0.75000000 Y=0.50000000 Z=0.57810000
      -4: X=0.25000000 Y=0.50000000 Z=0.42190000
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  -5: X=0.04110000 Y=0.13650000 Z=0.30680000
          MULT= 8          ISPLIT= 8
      -5: X=0.95890000 Y=0.86350000 Z=0.69320000
      -5: X=0.54110000 Y=0.13650000 Z=0.69320000
      -5: X=0.45890000 Y=0.86350000 Z=0.30680000
      -5: X=0.95890000 Y=0.63650000 Z=0.80680000
      -5: X=0.04110000 Y=0.36350000 Z=0.19320000
      -5: X=0.45890000 Y=0.63650000 Z=0.19320000
      -5: X=0.54110000 Y=0.36350000 Z=0.80680000
As         NPT=  781  R0=.000050000 RMT= 2.30        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  -6: X=0.54070000 Y=0.17580000 Z=0.09530000
          MULT= 8          ISPLIT= 8
      -6: X=0.45930000 Y=0.82420000 Z=0.90470000
      -6: X=0.04070000 Y=0.17580000 Z=0.90470000
      -6: X=0.95930000 Y=0.82420000 Z=0.09530000
      -6: X=0.45930000 Y=0.67580000 Z=0.59530000
      -6: X=0.54070000 Y=0.32420000 Z=0.40470000
      -6: X=0.95930000 Y=0.67580000 Z=0.40470000
      -6: X=0.04070000 Y=0.32420000 Z=0.59530000
As         NPT=  781  R0=.000050000 RMT= 2.30        Z:  33.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000