BN49QM
  -OEChem-04012117212D

 47 50  0     0  0  0  0  0  0999 V2000
    3.4782   -2.6865    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   11.3769    3.8080    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   12.3769    2.8080    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   10.3769    2.8080    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    9.6448    1.8080    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0468    0.3080    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1808   -1.1920    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3147   -1.6920    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6691   -1.2853    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -2.0284    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.7788    1.3080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9128    1.8080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7788    0.3080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0468    1.3080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9128   -0.1920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1808   -0.1920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5109    1.3080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3147    0.3080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3769    1.8080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5109    0.3080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4487   -0.1920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4487   -1.1920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2429    1.3080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3769    2.8080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3769   -0.1920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2429    0.3080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5827   -1.6920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5000   -2.8944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0933   -3.8080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3158    0.9980    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3113    2.2829    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5143    2.2829    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9909   -0.2746    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3894    0.4157    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8347    1.8906    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4362    1.2003    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5143   -0.6670    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3113   -0.6670    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3147    0.9280    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9739   -0.0020    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9118    0.1180    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7799    1.6180    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.3769   -0.8120    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7799   -0.0020    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5269   -3.5558    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8411   -4.3744    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6597   -4.0602    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 27  1  0  0  0  0
  1 28  1  0  0  0  0
  2 24  1  0  0  0  0
  3 24  1  0  0  0  0
  4 24  1  0  0  0  0
  5 11  1  0  0  0  0
  5 17  1  0  0  0  0
  6 14  1  0  0  0  0
  6 15  1  0  0  0  0
  6 16  1  0  0  0  0
  7  8  1  0  0  0  0
  7 16  2  0  0  0  0
  8 22  2  0  0  0  0
  9 10  1  0  0  0  0
  9 27  2  0  0  0  0
 10 28  2  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 11 30  1  0  0  0  0
 12 14  1  0  0  0  0
 12 31  1  0  0  0  0
 12 32  1  0  0  0  0
 13 15  1  0  0  0  0
 13 33  1  0  0  0  0
 13 34  1  0  0  0  0
 14 35  1  0  0  0  0
 14 36  1  0  0  0  0
 15 37  1  0  0  0  0
 15 38  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 17 20  2  0  0  0  0
 18 21  2  0  0  0  0
 18 39  1  0  0  0  0
 19 23  2  0  0  0  0
 19 24  1  0  0  0  0
 20 25  1  0  0  0  0
 20 40  1  0  0  0  0
 21 22  1  0  0  0  0
 21 41  1  0  0  0  0
 22 27  1  0  0  0  0
 23 26  1  0  0  0  0
 23 42  1  0  0  0  0
 25 26  2  0  0  0  0
 25 43  1  0  0  0  0
 26 44  1  0  0  0  0
 28 29  1  0  0  0  0
 29 45  1  0  0  0  0
 29 46  1  0  0  0  0
 29 47  1  0  0  0  0
M  END

$$$$