CXZ LATTICE,NONEQUIV.ATOMS   3   15 B2/b                                       
MODE OF CALC=RELA unit=bohr                                                    
 10.040115 10.998206 21.049659 90.000000 90.000000 69.360000                   
ATOM  -1: X=0.00000000 Y=0.25000000 Z=0.06241000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.75000000 Z=0.93759000
Mo         NPT=  781  R0=.000010000 RMT= 2.43        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=0.77377000 Y=0.32203000 Z=0.41141000
          MULT= 4          ISPLIT= 8
      -2: X=0.22623000 Y=0.67797000 Z=0.58859000
      -2: X=0.22623000 Y=0.17797000 Z=0.41141000
      -2: X=0.77377000 Y=0.82203000 Z=0.58859000
P          NPT=  781  R0=.000100000 RMT= 1.99        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=0.72612000 Y=0.18996000 Z=0.22115000
          MULT= 4          ISPLIT= 8
      -3: X=0.27388000 Y=0.81004000 Z=0.77885000
      -3: X=0.27388000 Y=0.31004000 Z=0.22115000
      -3: X=0.72612000 Y=0.68996000 Z=0.77885000
P          NPT=  781  R0=.000100000 RMT= 1.99        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000