R   LATTICE,NONEQUIV.ATOMS   7  161 R3c     
MODE OF CALC=RELA unit=bohr
 36.660687 36.660687 15.306773 90.000000 90.000000120.000000
ATOM  -1: X=0.53600000 Y=0.36000000 Z=0.14800000
          MULT= 6          ISPLIT=15
      -1: X=0.36000000 Y=0.14800000 Z=0.53600000
      -1: X=0.03600000 Y=0.64800000 Z=0.86000000
      -1: X=0.14800000 Y=0.53600000 Z=0.36000000
      -1: X=0.64800000 Y=0.86000000 Z=0.03600000
      -1: X=0.86000000 Y=0.03600000 Z=0.64800000
Ge         NPT=  781  R0=.000050000 RMT=   2.00000   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  -2: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT=15
      -2: X=0.50000000 Y=0.50000000 Z=0.50000000
La         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  57.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.52800000 Y=0.06900000 Z=0.29400000
          MULT= 6          ISPLIT=15
      -3: X=0.06900000 Y=0.29400000 Z=0.52800000
      -3: X=0.02800000 Y=0.79400000 Z=0.56900000
      -3: X=0.29400000 Y=0.52800000 Z=0.06900000
      -3: X=0.79400000 Y=0.56900000 Z=0.02800000
      -3: X=0.56900000 Y=0.02800000 Z=0.79400000
La         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  57.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.11400000 Y=0.18301000 Z=0.71700000
          MULT= 6          ISPLIT=15
      -4: X=0.18301000 Y=0.71700000 Z=0.11400000
      -4: X=0.61400000 Y=0.21700000 Z=0.68301000
      -4: X=0.71700000 Y=0.11400000 Z=0.18301000
      -4: X=0.21700000 Y=0.68301000 Z=0.61400000
      -4: X=0.68301000 Y=0.61400000 Z=0.21700000
S          NPT=  781  R0=.000100000 RMT=   2.00000   Z:  16.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.31300000 Y=0.31000000 Z=0.12400000
          MULT= 6          ISPLIT=15
      -5: X=0.31000000 Y=0.12400000 Z=0.31300000
      -5: X=0.81300000 Y=0.62400000 Z=0.81000000
      -5: X=0.12400000 Y=0.31300000 Z=0.31000000
      -5: X=0.62400000 Y=0.81000000 Z=0.81300000
      -5: X=0.81000000 Y=0.81300000 Z=0.62400000
S          NPT=  781  R0=.000100000 RMT=   2.00000   Z:  16.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.20400000 Y=0.88800000 Z=0.91700000
          MULT= 6          ISPLIT=15
      -6: X=0.88800000 Y=0.91700000 Z=0.20400000
      -6: X=0.70400000 Y=0.41700000 Z=0.38800000
      -6: X=0.91700000 Y=0.20400000 Z=0.88800000
      -6: X=0.41700000 Y=0.38800000 Z=0.70400000
      -6: X=0.38800000 Y=0.70400000 Z=0.41700000
S          NPT=  781  R0=.000100000 RMT=   2.00000   Z:  16.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.42200000 Y=0.15499000 Z=0.87700000
          MULT= 6          ISPLIT=15
      -7: X=0.15499000 Y=0.87700000 Z=0.42200000
      -7: X=0.92200000 Y=0.37700000 Z=0.65499000
      -7: X=0.87700000 Y=0.42200000 Z=0.15499000
      -7: X=0.37700000 Y=0.65499000 Z=0.92200000
      -7: X=0.65499000 Y=0.92200000 Z=0.37700000
S          NPT=  781  R0=.000100000 RMT=   2.00000   Z:  16.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000