IBS-ZINC01699938
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 16 15  0  0  0  0  0  0  0  0999 V2000
   -0.1720    1.5030   -0.1080 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1130   -0.0260   -0.0270 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8070   -0.7580    0.4550 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7320    3.4900    1.2100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0230    4.0080    2.6500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0000    3.4780    3.2650 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7700    2.0050   -0.3610 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8820    1.6960   -0.9230 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4960    3.8780    0.5240 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2360    3.9020    0.8970 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3340    1.8310    2.3110 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2360   -0.3800   -0.5010 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.6630    2.0100    1.1950 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2650    4.9510    3.0350 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.0190    1.5060    1.3800 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9520    0.4730    1.4100 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  7  1  0  0  0  0
  1  8  1  0  0  0  0
  1 13  1  0  0  0  0
  2  3  2  0  0  0  0
  2 12  1  0  0  0  0
  4  5  1  0  0  0  0
  4  9  1  0  0  0  0
  4 10  1  0  0  0  0
  4 13  1  0  0  0  0
  5  6  2  0  0  0  0
  5 14  1  0  0  0  0
 11 15  1  0  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
M  CHG  1  12  -1
M  CHG  1  14  -1
M  END