C11H16O
  AspenMD 06302522082D 1   0.01000     0.00000

 12 12  0     0  0              1 V2000
    0.6406    1.2311    0.0000 C   0  0  0  0  0  0           0  0  0
    0.0552    0.8057    0.0000 C   0  0  0  0  0  0           0  0  0
    0.2788    0.1173    0.0000 C   0  0  0  0  0  0           0  0  0
    1.0026    0.1173    0.0000 C   0  0  0  0  0  0           0  0  0
    1.2262    0.8057    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.5866    1.1500    0.0000 C   0  0  0  0  0  0           0  0  0
    1.4628   -0.2742    0.0000 O   0  0  0  0  0  0           0  0  0
   -0.0888   -0.2973    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.7604   -0.3089    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.0961   -0.6794    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.8530   -1.1310    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.2814   -1.5362    0.0000 C   0  0  0  0  0  0           0  0  0
  1  2  1  0     0  0
  2  3  2  0     0  0
  3  4  1  0     0  0
  4  5  1  0     0  0
  1  5  1  0     0  0
  2  6  1  0     0  0
  4  7  2  0     0  0
  3  8  1  0     0  0
  8  9  1  0     0  0
  9 10  2  0     0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
M  END