P   LATTICE,NONEQUIV.ATOMS   4   52 Pnna                                       
MODE OF CALC=RELA unit=bohr                                                    
 10.655032 22.247746  9.374553 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.25000000 Y=0.00000000 Z=0.77920000
          MULT= 4          ISPLIT= 8
      -1: X=0.75000000 Y=0.00000000 Z=0.22080000
      -1: X=0.75000000 Y=0.50000000 Z=0.27920000
      -1: X=0.25000000 Y=0.50000000 Z=0.72080000
Bi         NPT=  781  R0=.000005000 RMT= 2.20        Z:  83.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.13710000 Y=0.25000000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -2: X=0.86290000 Y=0.75000000 Z=0.75000000
      -2: X=0.63710000 Y=0.25000000 Z=0.75000000
      -2: X=0.36290000 Y=0.75000000 Z=0.25000000
Ta         NPT=  781  R0=.000005000 RMT= 1.99        Z:  73.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.36400000 Y=0.19700000 Z=0.53700000
          MULT= 8          ISPLIT= 8
      -3: X=0.63600000 Y=0.80300000 Z=0.46300000
      -3: X=0.86400000 Y=0.19700000 Z=0.46300000
      -3: X=0.13600000 Y=0.80300000 Z=0.53700000
      -3: X=0.63600000 Y=0.69700000 Z=0.03700000
      -3: X=0.36400000 Y=0.30300000 Z=0.96300000
      -3: X=0.13600000 Y=0.69700000 Z=0.96300000
      -3: X=0.86400000 Y=0.30300000 Z=0.03700000
O          NPT=  781  R0=.000100000 RMT= 1.71        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  -4: X=0.08100000 Y=0.09300000 Z=0.09400000
          MULT= 8          ISPLIT= 8
      -4: X=0.91900000 Y=0.90700000 Z=0.90600000
      -4: X=0.58100000 Y=0.09300000 Z=0.90600000
      -4: X=0.41900000 Y=0.90700000 Z=0.09400000
      -4: X=0.91900000 Y=0.59300000 Z=0.59400000
      -4: X=0.08100000 Y=0.40700000 Z=0.40600000
      -4: X=0.41900000 Y=0.59300000 Z=0.40600000
      -4: X=0.58100000 Y=0.40700000 Z=0.59400000
O          NPT=  781  R0=.000100000 RMT= 1.71        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000