F   LATTICE,NONEQUIV.ATOMS   3  216 F-43m                                      
MODE OF CALC=RELA unit=bohr                                                    
 18.783878 18.783878 18.783878 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.34940000 Y=0.34940000 Z=0.34940000
          MULT= 4          ISPLIT= 4
      -1: X=0.34940000 Y=0.65060000 Z=0.65060000
      -1: X=0.65060000 Y=0.65060000 Z=0.34940000
      -1: X=0.65060000 Y=0.34940000 Z=0.65060000
Mo         NPT=  781  R0=.000010000 RMT= 2.36        Z:  42.00000              
LOCAL ROT MATRIX:    0.4082483-0.7071068 0.5773503
                     0.4082483 0.7071068 0.5773503
                    -0.8164966 0.0000000 0.5773503
ATOM  -2: X=0.11840000 Y=0.11840000 Z=0.11840000
          MULT= 4          ISPLIT= 4
      -2: X=0.11840000 Y=0.88160000 Z=0.88160000
      -2: X=0.88160000 Y=0.88160000 Z=0.11840000
      -2: X=0.88160000 Y=0.11840000 Z=0.88160000
S          NPT=  781  R0=.000100000 RMT= 2.03        Z:  16.00000              
LOCAL ROT MATRIX:    0.4082483-0.7071068 0.5773503
                     0.4082483 0.7071068 0.5773503
                    -0.8164966 0.0000000 0.5773503
ATOM  -3: X=0.62270000 Y=0.62270000 Z=0.62270000
          MULT= 4          ISPLIT= 4
      -3: X=0.62270000 Y=0.37730000 Z=0.37730000
      -3: X=0.37730000 Y=0.37730000 Z=0.62270000
      -3: X=0.37730000 Y=0.62270000 Z=0.37730000
Br         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  35.00000              
LOCAL ROT MATRIX:    0.4082483-0.7071068 0.5773503
                     0.4082483 0.7071068 0.5773503
                    -0.8164966 0.0000000 0.5773503