A1DOF
  CCTOOLS-0731261037

 23 24  0  0  0  0  0  0  0  0999 V2000
    3.4880    1.7290   -0.0020 N   0  0  0  0  0
    3.3600    0.3870   -0.0010 C   0  0  0  0  0
    4.3520   -0.3180   -0.0000 O   0  0  0  0  0
    2.0280   -0.2210   -0.0000 C   0  0  0  0  0
    1.7550   -1.5720    0.0010 C   0  0  0  0  0
    0.3630   -1.7030    0.0010 C   0  0  0  0  0
   -0.1590   -0.4410   -0.0000 C   0  0  0  0  0
   -1.5970   -0.1040    0.0000 C   0  0  0  0  0
   -2.0040    1.2320   -0.0010 C   0  0  0  0  0
   -3.3490    1.5390   -0.0010 C   0  0  0  0  0
   -4.2930    0.5280    0.0010 C   0  0  0  0  0
   -3.8970   -0.7980    0.0020 C   0  0  0  0  0
   -2.5550   -1.1200   -0.0050 C   0  0  0  0  0
    0.8530    0.4430    0.0050 O   0  0  0  0  0
    4.3710    2.1320   -0.0020 H   0  0  0  0  0
    2.6980    2.2920   -0.0060 H   0  0  0  0  0
    2.4780   -2.3750    0.0010 H   0  0  0  0  0
   -0.1950   -2.6280    0.0010 H   0  0  0  0  0
   -1.2680    2.0220   -0.0010 H   0  0  0  0  0
   -3.6650    2.5720   -0.0010 H   0  0  0  0  0
   -5.3450    0.7750    0.0010 H   0  0  0  0  0
   -4.6390   -1.5820    0.0030 H   0  0  0  0  0
   -2.2470   -2.1550   -0.0090 H   0  0  0  0  0
  1  2  1  0  0  0
  1 15  1  0  0  0
  1 16  1  0  0  0
  2  3  2  0  0  0
  2  4  1  0  0  0
  4  5  2  0  0  0
  4 14  1  0  0  0
  5  6  1  0  0  0
  5 17  1  0  0  0
  6  7  2  0  0  0
  6 18  1  0  0  0
  7  8  1  0  0  0
  7 14  1  0  0  0
  8  9  2  0  0  0
  8 13  1  0  0  0
  9 10  1  0  0  0
  9 19  1  0  0  0
 10 11  2  0  0  0
 10 20  1  0  0  0
 11 12  1  0  0  0
 11 21  1  0  0  0
 12 13  2  0  0  0
 12 22  1  0  0  0
 13 23  1  0  0  0
M  END
$$$$
