A4504.cdx
  ChemDraw06111414052D

 45 50  0  0  0  0  0  0  0  0999 V2000
   -1.4289    0.3137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1433   -0.0988    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1433   -0.9238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -1.3363    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7144   -0.9238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7144   -0.0988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0001   -1.3363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7146   -0.9238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7146   -0.0988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0001    0.3137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8577   -1.3363    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5394   -0.8716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3277   -1.1148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6291   -1.8827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2166   -2.5972    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4009   -2.7202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7961   -2.1590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6291   -3.3116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4540   -3.3116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2166   -4.0260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    1.1386    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1433    1.5511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1433    2.3761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8577    2.7886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5722    2.3761    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5722    1.5511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8577    1.1386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2866    2.7885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2866    3.6135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0011    4.0260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7156    3.6135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7156    2.7885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0011    2.3760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4290   -1.3363    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.9238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8578   -1.3363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5722   -0.9238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2866   -1.3363    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.0011   -0.9238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7156   -1.3363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2866   -2.1613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0011   -2.5738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7156   -2.1613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4290    0.3136    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4290    1.1386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0      
  2  3  2  0      
  3  4  1  0      
  4  5  2  0      
  5  6  1  0      
  6  1  2  0      
  5  7  1  0      
  7  8  2  0      
  8  9  1  0      
  9 10  2  0      
 10  6  1  0      
  3 11  1  0      
 11 12  1  0      
 12 13  1  0      
 13 14  1  0      
 14 15  1  0      
 15 16  1  0      
 16 17  1  0      
 17 11  1  0      
 15 18  1  0      
 18 19  1  0      
 18 20  1  0      
  1 21  1  0      
 21 22  1  0      
 22 23  1  0      
 23 24  1  0      
 24 25  1  0      
 25 26  1  0      
 26 27  1  0      
 27 22  1  0      
 25 28  1  0      
 28 29  1  0      
 29 30  1  0      
 30 31  1  0      
 31 32  1  0      
 32 33  1  0      
 33 28  1  0      
  8 34  1  0      
 34 35  1  0      
 35 36  1  0      
 36 37  1  0      
 37 38  1  0      
 38 39  1  0      
 39 40  1  0      
 38 41  1  0      
 41 42  1  0      
 42 43  1  0      
 40 43  1  0      
  9 44  1  0      
 44 45  1  0      
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  44  45
M  SBL   1  1  49
M  SMT   1 OMe
M  SBV   1  49   -0.7144   -0.4125
M  END
$$$$
