XIE
  CCTOOLS-1121251003

 13 13  0  0  0  0  0  0  0  0999 V2000
   -1.7300    1.0040    0.0000 N   0  0  0  0  0
    1.9400    0.5310    0.0000 C   0  0  0  0  0
    0.4990    0.2350   -0.0000 C   0  0  0  0  0
    0.0430   -1.0920   -0.0000 C   0  0  0  0  0
   -1.3220   -1.3150   -0.0000 C   0  0  0  0  0
   -2.1860   -0.2350    0.0000 C   0  0  0  0  0
   -0.4410    1.2700   -0.0000 C   0  0  0  0  0
    2.2800    1.5560   -0.0000 H   0  0  0  0  0
    0.7400   -1.9170   -0.0010 H   0  0  0  0  0
   -1.7100   -2.3230    0.0000 H   0  0  0  0  0
   -3.2520   -0.4080    0.0010 H   0  0  0  0  0
   -0.1070    2.2970   -0.0000 H   0  0  0  0  0
    2.7460   -0.3750    0.0000 O   0  0  0  0  0
  1  6  1  0  0  0
  2  3  1  0  0  0
  2  8  1  0  0  0
  2 13  2  0  0  0
  3  4  2  0  0  0
  3  7  1  0  0  0
  4  5  1  0  0  0
  4  9  1  0  0  0
  5  6  2  0  0  0
  5 10  1  0  0  0
  6 11  1  0  0  0
  7  1  2  0  0  0
  7 12  1  0  0  0
M  END
$$$$
