BN8J1I
  -OEChem-04012112053D

 20 21  0     0  0  0  0  0  0999 V2000
    4.7857   -0.5372    0.6326 S   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7785    1.1281    0.4728 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3579   -0.0031    0.0028 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7066   -0.0221   -0.0054 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1671    0.7673   -0.8768 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4167   -1.1251   -0.4661 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1053   -0.7586    0.8753 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4281    1.0699    0.4493 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8070   -1.1029   -0.4578 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5104    0.5716   -0.6429 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9252   -0.0097    0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4346    0.0373    0.0174 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2801   -0.0154   -0.0018 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7937    1.4335   -1.6446 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9008   -2.0085   -0.8341 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7560   -1.4322    1.6462 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9333    1.9623    0.8217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3813   -1.9512   -0.8120 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3434    1.0268   -1.1600 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5172    0.1048    0.0449 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  1  0  0  0  0
  1 10  1  0  0  0  0
  2  8  1  0  0  0  0
  2 12  2  0  0  0  0
  3  5  1  0  0  0  0
  3  7  2  0  0  0  0
  3 11  1  0  0  0  0
  4  6  1  0  0  0  0
  4  8  2  0  0  0  0
  4 13  1  0  0  0  0
  5 10  2  0  0  0  0
  5 14  1  0  0  0  0
  6  9  2  0  0  0  0
  6 15  1  0  0  0  0
  7 16  1  0  0  0  0
  8 17  1  0  0  0  0
  9 12  1  0  0  0  0
  9 18  1  0  0  0  0
 10 19  1  0  0  0  0
 11 13  3  0  0  0  0
 12 20  1  0  0  0  0
M  END

$$$$