PJL
  CCTOOLS-0919241032

 18 17  0  0  0  0  0  0  0  0999 V2000
   -2.9320   -1.0190   -0.7450 O   0  0  0  0  0
   -3.2270    0.0160   -0.1970 C   0  0  0  0  0
   -4.4670    0.5140   -0.3260 O   0  0  0  0  0
   -2.2060    0.7450    0.6370 C   0  0  0  0  0
   -0.9080   -0.0210    0.6250 C   0  0  0  0  0
    0.1860    0.5660    0.2580 N   0  0  0  0  0
    1.3470   -0.1190    0.2470 C   0  0  0  0  0
    1.3660   -1.2900    0.5830 O   0  0  0  0  0
    2.5460    0.5230   -0.1550 C   0  0  0  0  0
    3.7050   -0.1620   -0.1660 C   0  0  0  0  0
    4.8440    0.4490   -0.5490 O   0  0  0  0  0
   -5.0890    0.0090   -0.8680 H   0  0  0  0  0
   -2.0440    1.7410    0.2250 H   0  0  0  0  0
   -2.5680    0.8310    1.6620 H   0  0  0  0  0
   -0.8910   -1.0590    0.9230 H   0  0  0  0  0
    2.5290    1.5610   -0.4530 H   0  0  0  0  0
    3.7220   -1.1990    0.1310 H   0  0  0  0  0
    5.6520   -0.0830   -0.5400 H   0  0  0  0  0
  1  2  2  0  0  0
  2  4  1  0  0  0
  2  3  1  0  0  0
  3 12  1  0  0  0
  4 13  1  0  0  0
  4 14  1  0  0  0
  5  4  1  0  0  0
  5 15  1  0  0  0
  6  5  2  0  0  0
  7  6  1  0  0  0
  8  7  2  0  0  0
  9  7  1  0  0  0
  9 16  1  0  0  0
 10  9  2  0  0  0
 10 17  1  0  0  0
 11 10  1  0  0  0
 11 18  1  0  0  0
M  END
$$$$