NCID-ZINC05341473
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 16 15  0  0  0  0  0  0  0  0999 V2000
    0.0410    1.5640   -0.1260 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1480    0.0840    0.0360 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1120   -0.5860    1.2070 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1080   -0.0210    2.5850 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9360   -0.5510    3.5730 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7430   -1.7300    3.9910 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3880   -0.7060   -1.2900 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0990   -1.9370   -1.2710 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.4150    2.0540    0.7750 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7710    1.7680   -0.9170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9070    2.0400   -0.3990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2480   -1.6690    1.1840 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1020   -0.3250    2.9370 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0850    1.0710    2.6040 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8450    0.2690    3.8960 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.8320   -0.0100   -2.2510 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  9  1  0  0  0  0
  1 10  1  0  0  0  0
  1 11  1  0  0  0  0
  2  3  2  0  0  0  0
  2  7  1  0  0  0  0
  3  4  1  0  0  0  0
  3 12  1  0  0  0  0
  4  5  1  0  0  0  0
  4 13  1  0  0  0  0
  4 14  1  0  0  0  0
  5  6  2  0  0  0  0
  5 15  1  0  0  0  0
  7  8  1  0  0  0  0
  7 16  2  0  0  0  0
M  CHG  1   8  -1
M  CHG  1  15  -1
M  END