%chk=C6N4Cu3.chk
%nproc=8
#P B3LYP/LANL2DZ  opt(Z-Matrix,MaxCycles=900) SCF=(MaxCycles=900) nosymm Pop=Full Freq=Raman

C6N4Cu3

0 2
  C     0.653674000     0.079178000    -0.131606000    
  C    -0.024056000     0.665058000     1.114617000    
  C    -1.088724000     1.568470000     0.938995000    
  C     0.783465000     0.960589000     2.250631000    
  C     1.819098000    -0.638257000    -0.072227000    
  C    -0.054619000     0.024562000    -1.352755000    
  N    -0.649717000    -0.021153000    -2.380202000    
  N     2.916292000    -1.130069000    -0.204517000    
  N    -2.080047000     2.237902000     1.098554000    
  N     1.455503000     1.206536000     3.196048000    
 Cu     3.479141000    -2.796625000     0.513023000    
 Cu    -2.630591000     3.716730000     0.022171000    
 Cu    -0.594354000    -1.361867000     1.077598000