BJQ2S8
  -OEChem-04012114053D

 31 32  0     0  0  0  0  0  0999 V2000
    2.3687    0.7734    0.6347 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0447   -0.1092   -0.1000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8847    0.8749   -0.4689 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9917   -1.1101   -0.2102 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5857    0.2213   -0.0816 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5676   -0.9038   -0.3959 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2379   -0.3199    0.3737 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0277    0.5547    0.4524 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8980   -0.3600   -0.8913 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6918    0.1113    0.0833 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5051   -0.7181    0.6505 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2045    1.6083    0.0716 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8594   -0.9405    0.4653 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1600    1.3858   -0.1136 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7174   -1.2867    0.0508 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0457    0.2186   -0.5208 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9964    0.8786    0.6950 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4410    0.8560   -0.9651 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1453   -1.5653   -1.1612 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7370   -1.5113    0.5006 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8493   -0.9647   -0.4255 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3601   -0.9088    1.2901 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7666    0.2241   -1.8078 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3640    0.2828   -0.1376 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5865   -1.1826   -1.1087 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1137   -1.5562    0.9757 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6156    2.6019   -0.0827 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2201   -1.9491    0.6383 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7748    2.2313   -0.4112 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2788   -2.2310    0.3407 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9597    0.7244   -0.7940 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  1  0  0  0  0
  1  8  1  0  0  0  0
  2  3  1  0  0  0  0
  2 10  1  0  0  0  0
  2 15  1  0  0  0  0
  3 16  2  0  0  0  0
  4 15  2  0  0  0  0
  4 16  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5 17  1  0  0  0  0
  5 18  1  0  0  0  0
  6  9  1  0  0  0  0
  6 19  1  0  0  0  0
  6 20  1  0  0  0  0
  7 21  1  0  0  0  0
  7 22  1  0  0  0  0
  8 11  2  0  0  0  0
  8 12  1  0  0  0  0
  9 23  1  0  0  0  0
  9 24  1  0  0  0  0
  9 25  1  0  0  0  0
 10 13  2  0  0  0  0
 10 14  1  0  0  0  0
 11 13  1  0  0  0  0
 11 26  1  0  0  0  0
 12 14  2  0  0  0  0
 12 27  1  0  0  0  0
 13 28  1  0  0  0  0
 14 29  1  0  0  0  0
 15 30  1  0  0  0  0
 16 31  1  0  0  0  0
M  END

$$$$