42 
OPV3CN molec optimized by CAM-B3LYPp2p, SG=2/m
  C        -8.09755167     0.16282486     0.00000000
  C        -7.39791922    -1.03967294     0.00000000
  C        -6.01091314    -1.05313980     0.00000000
  C        -5.28847022     0.15007421     0.00000000
  C        -6.01184707     1.35322493     0.00000000
  C        -7.39775554     1.36390091     0.00000000
  H        -7.93719075    -1.98157368     0.00000000
  H        -5.49827585    -2.00502157     0.00000000
  H        -5.46984685     2.29493729     0.00000000
  H        -7.93077198     2.30930121     0.00000000
  C        -3.83057433     0.27181252     0.00000000
  H        -3.50575723     1.30717790     0.00000000
  C        -2.83710535    -0.64450520     0.00000000
  C        -3.12481468    -2.05163930     0.00000000
  N        -3.31045584    -3.19429597     0.00000000
  C        -1.39008257    -0.29947172     0.00000000
  C        -0.42318279    -1.31128900     0.00000000
  C         0.92990768    -1.02043163     0.00000000
  C         1.39008257     0.29947172     0.00000000
  C         0.42318279     1.31128900     0.00000000
  C        -0.92990768     1.02043163     0.00000000
  H        -0.73249475    -2.35057375     0.00000000
  H         1.62414259    -1.85252747     0.00000000
  H         0.73249475     2.35057375     0.00000000
  H        -1.62414259     1.85252747     0.00000000
  C         2.83710535     0.64450520     0.00000000
  C         3.12481468     2.05163930     0.00000000
  N         3.31045584     3.19429597     0.00000000
  C         3.83057433    -0.27181252     0.00000000
  H         3.50575723    -1.30717790     0.00000000
  C         5.28847022    -0.15007421     0.00000000
  C         6.01184707    -1.35322493     0.00000000
  C         7.39775554    -1.36390091     0.00000000
  C         8.09755167    -0.16282486     0.00000000
  C         7.39791922     1.03967294     0.00000000
  C         6.01091314     1.05313980     0.00000000
  H         5.46984685    -2.29493729     0.00000000
  H         7.93077198    -2.30930121     0.00000000
  H         7.93719075     1.98157368     0.00000000
  H         5.49827585     2.00502157     0.00000000
  H        -9.18302532     0.16277558     0.00000000
  H         9.18302532    -0.16277558     0.00000000
