BJS73U
  -OEChem-04042105583D

 41 44  0     0  0  0  0  0  0999 V2000
   -3.9018   -0.4225   -0.9916 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.6063   -0.8312    1.2030 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5397   -2.7058   -0.8727 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3753   -2.7449    0.2158 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9505    0.6892    0.2669 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1514    1.7555    0.9569 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6596    3.1649    0.6169 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1906    3.2468    0.6897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8578    2.2914   -0.3112 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1913    0.9514   -0.2846 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5816   -0.6892    0.1123 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5705   -1.3950   -0.5628 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4577   -1.4279    0.5008 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7706   -1.5546    1.6163 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7830   -1.7298    0.4871 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4099   -3.2968   -0.4467 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3038   -0.4176   -0.0455 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6409    0.2017   -1.0938 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4354    0.1462    0.5230 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1220    1.4149   -1.5863 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9163    1.3595    0.0306 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2595    1.9938   -1.0240 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1976    1.5975    2.0407 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1046    1.7220    0.6401 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2116    3.8910    1.3046 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3349    3.4399   -0.3952 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5213    4.2725    0.4915 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5144    2.9969    1.7084 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7731    2.7092   -1.3220 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9249    2.2063   -0.0763 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5184    0.1209    1.5210 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4994   -2.5325    2.0326 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2433   -1.0025    2.4383 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6257   -2.3323    0.8504 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3472   -2.3080   -0.3377 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3192   -4.3554   -0.6637 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7566   -0.2410   -1.5431 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9524   -0.3388    1.3459 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6109    1.9085   -2.4077 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8017    1.8108    0.4686 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6339    2.9385   -1.4071 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0
  1 12  1  0  0  0  0
  2 13  1  0  0  0  0
  2 14  1  0  0  0  0
  2 31  1  0  0  0  0
  3 12  2  0  0  0  0
  3 16  1  0  0  0  0
  4 13  1  0  0  0  0
  4 16  2  0  0  0  0
  5  6  1  0  0  0  0
  5 10  2  0  0  0  0
  5 11  1  0  0  0  0
  6  7  1  0  0  0  0
  6 23  1  0  0  0  0
  6 24  1  0  0  0  0
  7  8  1  0  0  0  0
  7 25  1  0  0  0  0
  7 26  1  0  0  0  0
  8  9  1  0  0  0  0
  8 27  1  0  0  0  0
  8 28  1  0  0  0  0
  9 10  1  0  0  0  0
  9 29  1  0  0  0  0
  9 30  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
 14 15  1  0  0  0  0
 14 32  1  0  0  0  0
 14 33  1  0  0  0  0
 15 17  1  0  0  0  0
 15 34  1  0  0  0  0
 15 35  1  0  0  0  0
 16 36  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 18 37  1  0  0  0  0
 19 21  2  0  0  0  0
 19 38  1  0  0  0  0
 20 22  2  0  0  0  0
 20 39  1  0  0  0  0
 21 22  1  0  0  0  0
 21 40  1  0  0  0  0
 22 41  1  0  0  0  0
M  END

$$$$