4-Aminobenzonitrile   C  C,1,B1  C,2,B2,1,A1  C,3,B3,2,A2,1,D1,0  C,4,B4,3,A3,2,D2,0  C,5,B5,4,A4,3,D3,0  H,2,B6,1,A5,6,D4,0  H,3,B7,2,A6,1,D5,0  H,5,B8,4,A7,3,D6,0  H,6,B9,5,A8,4,D7,0  C,1,B10,2,A9,3,D8,0  N,11,B11,2,A10,1,D9,0  N,4,B12,3,A11,2,D10,0  H,13,B13,4,A12,3,D11,0  H,13,B14,4,A13,3,D12,0
	B3P86/6-31G(3d,3p)	M06-2X/6-31G(3d,3p)
	B1=1.4001618  B2=1.38089133  B3=1.40264195  B4=1.40264195  B5=1.38089133  B6=1.08393298  B7=1.08557503  B8=1.08557503  B9=1.08393298  B10=1.4240937  B11=1.15922833  B12=1.38044886  B13=1.00852764  B14=1.00852764  A1=120.52343412  A2=120.67749885  A3=118.63609095  A4=120.67749885  A5=119.42873409  A6=119.79056594  A7=119.53176532  A8=120.04778766  A9=120.51896792  A10=150.53680908  A11=120.65046972  A12=115.91025125  A13=115.91025125  D1=0.05913669  D2=-0.11412445  D3=0.11412445  D4=179.92184011  D5=-179.7902157  D6=-179.73561496  D7=179.86400709  D8=-179.87597265  D9=-179.93031041  D10=-177.24699058  D11=-159.11624901  D12=-23.80888434	B1=1.39745148  B2=1.38194545  B3=1.40123508  B4=1.40123508  B5=1.38194545  B6=1.08335992  B7=1.08469445  B8=1.08469445  B9=1.08335992  B10=1.43411433  B11=1.15382288  B12=1.38690005  B13=1.0092039  B14=1.0092039  A1=120.3094038  A2=120.53860345  A3=118.90503416  A4=120.53860345  A5=119.45732758  A6=119.99998768  A7=119.46119714  A8=120.23324921  A9=120.30064767  A10=150.57596167  A11=120.51201589  A12=114.99931511  A13=114.99931511  D1=0.09086583  D2=-0.20529635  D3=0.20529635  D4=179.97614359  D5=-179.74084645  D6=-179.62731729  D7=179.85817307  D8=-179.87023768  D9=-179.90472774  D10=-177.15833562  D11=-157.67125465  D12=-25.42491168
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			Last modified: 9 June 2014