P   LATTICE,NONEQUIV.ATOMS   4   52 Pnna                                       
MODE OF CALC=RELA unit=bohr                                                    
 21.083486 22.919543  8.802722 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.30820000 Y=0.25000000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -1: X=0.69180000 Y=0.75000000 Z=0.75000000
      -1: X=0.80820000 Y=0.25000000 Z=0.75000000
      -1: X=0.19180000 Y=0.75000000 Z=0.25000000
Ge         NPT=  781  R0=.000050000 RMT= 2.41        Z:  32.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.16160000 Y=0.08030000 Z=0.25530000
          MULT= 8          ISPLIT= 8
      -2: X=0.83840000 Y=0.91970000 Z=0.74470000
      -2: X=0.66160000 Y=0.08030000 Z=0.74470000
      -2: X=0.33840000 Y=0.91970000 Z=0.25530000
      -2: X=0.83840000 Y=0.58030000 Z=0.75530000
      -2: X=0.16160000 Y=0.41970000 Z=0.24470000
      -2: X=0.33840000 Y=0.58030000 Z=0.24470000
      -2: X=0.66160000 Y=0.41970000 Z=0.75530000
In         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  49.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.58880000 Y=0.25000000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -3: X=0.41120000 Y=0.75000000 Z=0.75000000
      -3: X=0.08880000 Y=0.25000000 Z=0.75000000
      -3: X=0.91120000 Y=0.75000000 Z=0.25000000
Sr         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  38.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.38170000 Y=0.09220000 Z=0.74180000
          MULT= 8          ISPLIT= 8
      -4: X=0.61830000 Y=0.90780000 Z=0.25820000
      -4: X=0.88170000 Y=0.09220000 Z=0.25820000
      -4: X=0.11830000 Y=0.90780000 Z=0.74180000
      -4: X=0.61830000 Y=0.59220000 Z=0.24180000
      -4: X=0.38170000 Y=0.40780000 Z=0.75820000
      -4: X=0.11830000 Y=0.59220000 Z=0.75820000
      -4: X=0.88170000 Y=0.40780000 Z=0.24180000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000