syn Anabasine  B3P86/6-31G(3d,3p) opt structure
 
 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
 N,5,B5,4,A4,3,D3,0
 H,6,B6,5,A5,4,D4,0
 H,3,B7,2,A6,1,D5,0
 H,3,B8,2,A7,1,D6,0
 H,1,B9,6,A8,5,D7,0
 H,2,B10,1,A9,6,D8,0
 H,2,B11,1,A10,6,D9,0
 H,4,B12,3,A11,2,D10,0
 H,4,B13,3,A12,2,D11,0
 H,5,B14,4,A13,3,D12,0
 H,5,B15,4,A14,3,D13,0
 C,1,B16,6,A15,5,D14,0
 C,17,B17,1,A16,6,D15,0
 C,17,B18,1,A17,6,D16,0
 N,18,B19,17,A18,1,D17,0
 H,18,B20,17,A19,1,D18,0
 C,19,B21,17,A20,1,D19,0
 H,19,B22,17,A21,1,D20,0
 C,20,B23,18,A22,17,D21,0
 H,22,B24,19,A23,17,D22,0
 H,24,B25,20,A24,18,D23,0
      Variables:
 B1=1.5333555
 B2=1.52580172
 B3=1.52614462
 B4=1.52148223
 B5=1.45782135
 B6=1.01465145
 B7=1.09797934
 B8=1.09437767
 B9=1.10758168
 B10=1.09612296
 B11=1.09432081
 B12=1.09589046
 B13=1.09441295
 B14=1.09368557
 B15=1.106401
 B16=1.50518177
 B17=1.39406305
 B18=1.39345917
 B19=1.33221342
 B20=1.08977132
 B21=1.38706199
 B22=1.08534409
 B23=1.33262429
 B24=1.08464438
 B25=1.08775303
 A1=111.16698857
 A2=110.78000378
 A3=110.23732836
 A4=109.83049209
 A5=109.95465509
 A6=109.21268859
 A7=110.27771894
 A8=111.35821383
 A9=108.14599516
 A10=109.19275196
 A11=109.8149555
 A12=110.69894131
 A13=110.59750528
 A14=108.83584086
 A15=110.21011469
 A16=120.97343922
 A17=121.7487285
 A18=124.55848002
 A19=119.49823691
 A20=119.01116857
 A21=119.49986931
 A22=117.06751052
 A23=121.11942228
 A24=116.09450051
 D1=53.21749684
 D2=-53.14448495
 D3=56.79513928
 D4=175.6601096
 D5=-67.08047749
 D6=176.24287572
 D7=-56.63717437
 D8=65.01061182
 D9=-178.67285924
 D10=66.73327613
 D11=-174.88018781
 D12=176.27073916
 D13=-66.20786864
 D14=-176.21129612
 D15=138.39313909
 D16=-42.78104627
 D17=178.19602535
 D18=-2.0340601
 D19=-178.43484389
 D20=2.32625189
 D21=0.35634597
 D22=-179.87913303
 D23=179.91081955
 
 
  anabasine_syn_zm.html
  Last modified: 1 Aug 2010