IBS-ZINC04772594
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 14 14  0  0  0  0  0  0  0  0999 V2000
    0.0910    1.3510   -0.5320 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0190    0.0710   -0.0040 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1750   -0.5400    0.4930 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4110    0.1280    0.4640 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.4740    1.4120   -0.0680 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3110    2.0200   -0.5650 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3260    3.6130   -1.2380 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.7710    2.1200   -0.1010 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0380    2.8490    0.9020 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.4530   -0.4510    0.9250 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0090   -2.1430    1.1400 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.8100    1.8230   -0.9190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9350   -0.4490    0.0210 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4620    1.9750   -1.1550 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 12  1  0  0  0  0
  2  3  2  0  0  0  0
  2 13  1  0  0  0  0
  3  4  1  0  0  0  0
  3 11  1  0  0  0  0
  4  5  2  0  0  0  0
  4 10  1  0  0  0  0
  5  6  1  0  0  0  0
  5  8  1  0  0  0  0
  6  7  1  0  0  0  0
  8  9  1  0  0  0  0
  8 14  2  0  0  0  0
M  CHG  1   4   1
M  CHG  1   9  -1
M  CHG  1  10  -1
M  END