Typical SDF Formatted Deposition
  -OEChem-11050415022D

 57 58  0  0  0  0  0  0  0  0999 V2000
   -6.7078    0.6187    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9933    1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2788    0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5644    1.0313    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8499    0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1354    1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4209    0.6187    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7065    1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9920    0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2775    1.0313    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4369    0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1514    1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8659    0.6187    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5803    1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2948    0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2788   -0.2062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1354    1.8563    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9920   -0.2062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1514    1.8563    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2948   -0.2062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0093    1.0313    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9933    1.8563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7065    1.8563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5803    1.8563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8499   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4369   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1354   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1354   -1.4437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4209   -1.8563    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4209   -2.6812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7065   -3.0938    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1354   -3.0938    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9920    2.2687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4209    2.2687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1514   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9379   -1.4156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5212   -1.9990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3181   -1.7855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5317   -0.9886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9483   -0.4052    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0326   -2.1980    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2948    2.2687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2948    3.0938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8659    2.2687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7238    0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4382    1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1527    0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4382    1.8563    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7238   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4382   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4382   -1.4437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2229   -1.6987    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7078   -1.0312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2229   -0.3638    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2788    2.2687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5668    1.8577    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2788    3.0909    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0      
  2  3  1  0      
  3  4  1  0      
  4  5  1  0      
  5  6  1  0      
  6  7  1  0      
  7  8  1  0      
  8  9  1  0      
  9 10  1  0      
 10 11  1  0      
 11 12  1  0      
 12 13  1  0      
 13 14  1  0      
 14 15  1  0      
  3 16  2  0      
  6 17  2  0      
  9 18  2  0      
 12 19  2  0      
 15 20  2  0      
 15 21  1  0      
  2 22  1  1      
  8 23  1  1      
 14 24  1  1      
  5 25  1  6      
 11 26  1  6      
 25 27  1  0      
 27 28  1  0      
 28 29  1  0      
 29 30  1  0      
 30 31  1  0      
 30 32  2  0      
 23 33  1  0      
 23 34  1  0      
 26 35  1  0      
 35 36  2  0      
 36 37  1  0      
 37 38  2  0      
 38 39  1  0      
 39 40  2  0      
 40 35  1  0      
 38 41  1  0      
 24 42  1  0      
 42 43  1  0      
 24 44  1  0      
 21 45  1  0      
 45 46  1  0      
 46 47  1  0      
 46 48  2  0      
 45 49  1  6      
 49 50  1  0      
 50 51  2  0      
 51 52  1  0      
 52 53  1  0      
 53 54  2  0      
 54 50  1  0      
 22 55  1  0      
 55 56  2  0      
 55 57  1  0      
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  3  55  56  57
M  SBL   1  1  56
M  SMT   1 COOH
M  SCL   1  
M  SBV   1  56   -0.7145   -0.4125
M  END
$$$$
