P   LATTICE,NONEQUIV.ATOMS   6   58 Pnnm                                       
MODE OF CALC=RELA unit=bohr                                                    
 20.276761 21.505083  8.371487 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.32100000 Y=0.42600000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.67900000 Y=0.57400000 Z=0.00000000
      -1: X=0.17900000 Y=0.92600000 Z=0.50000000
      -1: X=0.82100000 Y=0.07400000 Z=0.50000000
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
ATOM  -2: X=0.05300000 Y=0.64700000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -2: X=0.94700000 Y=0.35300000 Z=0.00000000
      -2: X=0.44700000 Y=0.14700000 Z=0.50000000
      -2: X=0.55300000 Y=0.85300000 Z=0.50000000
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
ATOM  -3: X=0.02800000 Y=0.10500000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -3: X=0.97200000 Y=0.89500000 Z=0.00000000
      -3: X=0.47200000 Y=0.60500000 Z=0.50000000
      -3: X=0.52800000 Y=0.39500000 Z=0.50000000
Ge         NPT=  781  R0=.000050000 RMT= 2.31        Z:  32.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.25700000 Y=0.14200000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -4: X=0.74300000 Y=0.85800000 Z=0.00000000
      -4: X=0.24300000 Y=0.64200000 Z=0.50000000
      -4: X=0.75700000 Y=0.35800000 Z=0.50000000
Ge         NPT=  781  R0=.000050000 RMT= 2.31        Z:  32.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.61200000 Y=0.04500000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -5: X=0.38800000 Y=0.95500000 Z=0.00000000
      -5: X=0.88800000 Y=0.54500000 Z=0.50000000
      -5: X=0.11200000 Y=0.45500000 Z=0.50000000
Ge         NPT=  781  R0=.000050000 RMT= 2.31        Z:  32.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.64300000 Y=0.28100000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -6: X=0.35700000 Y=0.71900000 Z=0.00000000
      -6: X=0.85700000 Y=0.78100000 Z=0.50000000
      -6: X=0.14300000 Y=0.21900000 Z=0.50000000
Li         NPT=  781  R0=.000100000 RMT= 2.14        Z:   3.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000