CXY LATTICE,NONEQUIV.ATOMS  10   20 C2221                                      
MODE OF CALC=RELA unit=bohr                                                    
 13.194635 32.657680 16.136560 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.25300000 Y=0.35280000 Z=0.35200000
          MULT= 4          ISPLIT= 8
      -1: X=0.74700000 Y=0.64720000 Z=0.85200000
      -1: X=0.25300000 Y=0.64720000 Z=0.64800000
      -1: X=0.74700000 Y=0.35280000 Z=0.14800000
Y          NPT=  781  R0=.000010000 RMT= 2.00        Z:  39.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.21200000 Y=0.05880000 Z=0.23070000
          MULT= 4          ISPLIT= 8
      -2: X=0.78800000 Y=0.94120000 Z=0.73070000
      -2: X=0.21200000 Y=0.94120000 Z=0.76930000
      -2: X=0.78800000 Y=0.05880000 Z=0.26930000
P          NPT=  781  R0=.000100000 RMT= 1.25        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.23200000 Y=0.33930000 Z=0.00950000
          MULT= 4          ISPLIT= 8
      -3: X=0.76800000 Y=0.66070000 Z=0.50950000
      -3: X=0.23200000 Y=0.66070000 Z=0.99050000
      -3: X=0.76800000 Y=0.33930000 Z=0.49050000
P          NPT=  781  R0=.000100000 RMT= 1.25        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.00000000 Y=0.05300000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -4: X=0.00000000 Y=0.94700000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.38        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.30700000 Y=0.08500000 Z=0.39100000
          MULT= 4          ISPLIT= 8
      -5: X=0.69300000 Y=0.91500000 Z=0.89100000
      -5: X=0.30700000 Y=0.91500000 Z=0.60900000
      -5: X=0.69300000 Y=0.08500000 Z=0.10900000
O          NPT=  781  R0=.000100000 RMT= 1.38        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=0.22500000 Y=0.48520000 Z=0.32400000
          MULT= 4          ISPLIT= 8
      -6: X=0.77500000 Y=0.51480000 Z=0.82400000
      -6: X=0.22500000 Y=0.51480000 Z=0.67600000
      -6: X=0.77500000 Y=0.48520000 Z=0.17600000
O          NPT=  781  R0=.000100000 RMT= 1.38        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=0.27600000 Y=0.10040000 Z=0.06900000
          MULT= 4          ISPLIT= 8
      -7: X=0.72400000 Y=0.89960000 Z=0.56900000
      -7: X=0.27600000 Y=0.89960000 Z=0.93100000
      -7: X=0.72400000 Y=0.10040000 Z=0.43100000
O          NPT=  781  R0=.000100000 RMT= 1.38        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  -8: X=0.10600000 Y=0.32260000 Z=0.15700000
          MULT= 4          ISPLIT= 8
      -8: X=0.89400000 Y=0.67740000 Z=0.65700000
      -8: X=0.10600000 Y=0.67740000 Z=0.84300000
      -8: X=0.89400000 Y=0.32260000 Z=0.34300000
O          NPT=  781  R0=.000100000 RMT= 1.38        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  -9: X=0.41900000 Y=0.35850000 Z=0.08800000
          MULT= 4          ISPLIT= 8
      -9: X=0.58100000 Y=0.64150000 Z=0.58800000
      -9: X=0.41900000 Y=0.64150000 Z=0.91200000
      -9: X=0.58100000 Y=0.35850000 Z=0.41200000
O          NPT=  781  R0=.000100000 RMT= 1.38        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 -10: X=0.25000000 Y=0.22290000 Z=0.40600000
          MULT= 4          ISPLIT= 8
     -10: X=0.75000000 Y=0.77710000 Z=0.90600000
     -10: X=0.25000000 Y=0.77710000 Z=0.59400000
     -10: X=0.75000000 Y=0.22290000 Z=0.09400000
O          NPT=  781  R0=.000100000 RMT= 1.38        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000