PUBCHEM-ZINC01529703
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 16 15  0  0  1  0  0  0  0  0999 V2000
   -0.0480    1.5240   -0.0190 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0430    0.0030   -0.0040 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.4520   -0.3680   -0.9090 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4610   -0.5600    0.0990 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4270   -2.0700    0.0920 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4320   -2.7140    0.4310 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6760   -2.8480   -0.2850 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7140   -2.1390   -0.4660 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.7350   -0.4240    1.1160 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6700   -1.4070    1.1170 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9760    1.9090   -0.0730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6120    1.9120   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4860    1.9240    0.9030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9390   -0.2500    1.0350 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0580   -0.2050   -0.7480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5760   -4.1080   -0.3910 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  9  1  0  0  0  0
  4  5  1  0  0  0  0
  4 14  1  0  0  0  0
  4 15  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7 16  2  0  0  0  0
  9 10  1  0  0  0  0
M  CHG  1   8  -1
M  END