# Molecule : Pyrazine
# Comment  : 
# code     : 
# method   : CCSD(2),aug-cc-pVTZ
# geom     : CC3,aug-cc-pVTZ
# set      : QUEST#3,2

# Initial state            Final state                        Transition                    Energies (eV)   %T1    Oscillator strength    unsafe
#######################  #######################  ########################################  ############# ####### ##################### #############
# Number  Spin  Symm       Number  Spin  Symm         type                                    E_abs         %T1            f            is unsafe
  1       1     A_g        1       1     B_{3u}       (\mathrm{V};n \rightarrow \pi^\star)    4.58          _              _            false
  1       1     A_g        1       1     A_u          (\mathrm{V};n \rightarrow \pi^\star)    5.40          _              _            false
  1       1     A_g        1       1     B_{2u}       (\mathrm{V};\pi \rightarrow \pi^\star)  5.50          _              _            false
  1       1     A_g        1       1     B_{2g}       (\mathrm{V};n \rightarrow \pi^\star)    6.23          _              _            false
  1       1     A_g        2       1     A_g          (\mathrm{R};n \rightarrow 3s)           7.04          _              _            false
  1       1     A_g        1       1     B_{1g}       (\mathrm{V};n \rightarrow \pi^\star)    7.30          _              _            false
  1       1     A_g        1       1     B_{1u}       (\mathrm{V};\pi \rightarrow \pi^\star)  7.14          _              _            false
  1       1     A_g        2       1     B_{1g}       (\mathrm{R};\pi \rightarrow 3p)         7.50          _              _            false
  1       1     A_g        2       1     B_{2u}       (\mathrm{R};\pi \rightarrow 3p)         7.66          _              _            false
  1       1     A_g        1       3     B_{3u}       (\mathrm{V};n \rightarrow \pi^\star)    3.94          _              _            false
  1       1     A_g        1       3     B_{1u}       (\mathrm{V};\pi \rightarrow \pi^\star)  4.60          _              _            false
  1       1     A_g        1       3     B_{2u}       (\mathrm{V};\pi \rightarrow \pi^\star)  4.72          _              _            false
  1       1     A_g        1       3     A_u          (\mathrm{V};n \rightarrow \pi^\star)    5.34          _              _            false
  1       1     A_g        1       3     B_{2g}       (\mathrm{V};n \rightarrow \pi^\star)    5.39          _              _            false
  1       1     A_g        2       3     B_{1u}       (\mathrm{V};\pi \rightarrow \pi^\star)  5.70          _              _            false