P   LATTICE,NONEQUIV.ATOMS   7   60 Pbcn                                       
MODE OF CALC=RELA unit=bohr                                                    
  9.580911 34.449707 15.023323 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.02290000 Y=0.39870000 Z=0.01610000
          MULT= 8          ISPLIT= 8
      -1: X=0.97710000 Y=0.60130000 Z=0.98390000
      -1: X=0.52290000 Y=0.89870000 Z=0.48390000
      -1: X=0.47710000 Y=0.10130000 Z=0.51610000
      -1: X=0.47710000 Y=0.89870000 Z=0.01610000
      -1: X=0.52290000 Y=0.10130000 Z=0.98390000
      -1: X=0.97710000 Y=0.39870000 Z=0.48390000
      -1: X=0.02290000 Y=0.60130000 Z=0.51610000
Mo         NPT=  781  R0=.000010000 RMT= 1.70        Z:  42.00000              
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=0.00610000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -2: X=0.00000000 Y=0.99390000 Z=0.75000000
      -2: X=0.50000000 Y=0.50610000 Z=0.25000000
      -2: X=0.50000000 Y=0.49390000 Z=0.75000000
Y          NPT=  781  R0=.000010000 RMT= 2.27        Z:  39.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.00000000 Y=0.76960000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -3: X=0.00000000 Y=0.23040000 Z=0.75000000
      -3: X=0.50000000 Y=0.26960000 Z=0.25000000
      -3: X=0.50000000 Y=0.73040000 Z=0.75000000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.27400000 Y=0.10000000 Z=0.34100000
          MULT= 8          ISPLIT= 8
      -4: X=0.72600000 Y=0.90000000 Z=0.65900000
      -4: X=0.77400000 Y=0.60000000 Z=0.15900000
      -4: X=0.22600000 Y=0.40000000 Z=0.84100000
      -4: X=0.22600000 Y=0.60000000 Z=0.34100000
      -4: X=0.77400000 Y=0.40000000 Z=0.65900000
      -4: X=0.72600000 Y=0.10000000 Z=0.15900000
      -4: X=0.27400000 Y=0.90000000 Z=0.84100000
O          NPT=  781  R0=.000100000 RMT= 1.54        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  -5: X=0.24700000 Y=0.40500000 Z=0.18700000
          MULT= 8          ISPLIT= 8
      -5: X=0.75300000 Y=0.59500000 Z=0.81300000
      -5: X=0.74700000 Y=0.90500000 Z=0.31300000
      -5: X=0.25300000 Y=0.09500000 Z=0.68700000
      -5: X=0.25300000 Y=0.90500000 Z=0.18700000
      -5: X=0.74700000 Y=0.09500000 Z=0.81300000
      -5: X=0.75300000 Y=0.40500000 Z=0.31300000
      -5: X=0.24700000 Y=0.59500000 Z=0.68700000
O          NPT=  781  R0=.000100000 RMT= 1.54        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  -6: X=0.25200000 Y=0.03500000 Z=0.00400000
          MULT= 8          ISPLIT= 8
      -6: X=0.74800000 Y=0.96500000 Z=0.99600000
      -6: X=0.75200000 Y=0.53500000 Z=0.49600000
      -6: X=0.24800000 Y=0.46500000 Z=0.50400000
      -6: X=0.24800000 Y=0.53500000 Z=0.00400000
      -6: X=0.75200000 Y=0.46500000 Z=0.99600000
      -6: X=0.74800000 Y=0.03500000 Z=0.49600000
      -6: X=0.25200000 Y=0.96500000 Z=0.50400000
O          NPT=  781  R0=.000100000 RMT= 1.54        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  -7: X=0.10200000 Y=0.31100000 Z=0.47200000
          MULT= 8          ISPLIT= 8
      -7: X=0.89800000 Y=0.68900000 Z=0.52800000
      -7: X=0.60200000 Y=0.81100000 Z=0.02800000
      -7: X=0.39800000 Y=0.18900000 Z=0.97200000
      -7: X=0.39800000 Y=0.81100000 Z=0.47200000
      -7: X=0.60200000 Y=0.18900000 Z=0.52800000
      -7: X=0.89800000 Y=0.31100000 Z=0.02800000
      -7: X=0.10200000 Y=0.68900000 Z=0.97200000
O          NPT=  781  R0=.000100000 RMT= 1.54        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000