BFM87V
  -OEChem-04012114233D

 17 17  0     0  0  0  0  0  0999 V2000
   -1.2402   -1.4340    0.0907 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.5761    0.0308    0.1376 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2523   -0.4318   -0.5393 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1992   -0.1369   -0.2520 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1743    0.3031    0.4357 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8086    1.0781   -0.2309 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1934    0.9515    0.0798 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5613   -0.3609    0.2785 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4523   -1.5101   -0.4942 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4690   -0.1163   -1.5686 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9627   -0.0045    1.4662 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0141    1.3858    0.3866 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3114    2.0191   -0.4279 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8848    1.7810    0.1527 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5427   -0.7409    0.5248 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7810    0.3085   -0.8217 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7450   -0.9737    0.1791 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  8  1  0  0  0  0
  2  5  1  0  0  0  0
  2 16  1  0  0  0  0
  2 17  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  9  1  0  0  0  0
  3 10  1  0  0  0  0
  4  6  2  0  0  0  0
  5 11  1  0  0  0  0
  5 12  1  0  0  0  0
  6  7  1  0  0  0  0
  6 13  1  0  0  0  0
  7  8  2  0  0  0  0
  7 14  1  0  0  0  0
  8 15  1  0  0  0  0
M  END

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