IBS-ZINC04764147
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 19 20  0  0  1  0  0  0  0  0999 V2000
   -0.0100    1.1080    0.0070 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.0040    0.0180    0.0070 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5270    1.4950   -0.0080 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.7470    2.5620   -0.0380 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8230    0.7880   -1.2620 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7320    1.0280   -2.0570 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7330    0.9010   -3.3980 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3640    1.0480   -4.0600 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.6430    2.1310   -4.5440 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1220    0.1050   -4.2020 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.3620    1.4140   -1.3200 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8480    0.8570    1.2720 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7540    1.0600    2.0640 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7610    0.9420    3.2740 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3530    1.4130    1.3330 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6130    0.2680   -1.4780 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1880    1.8080   -1.6410 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6650    0.3900    1.5070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1860    1.7880    1.6600 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1 11  1  0  0  0  0
  1 15  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3 12  1  0  0  0  0
  5  6  1  0  0  0  0
  5 16  1  0  0  0  0
  6  7  2  0  0  0  0
  6 11  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 11 17  1  0  0  0  0
 12 13  1  0  0  0  0
 12 18  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
 15 19  1  0  0  0  0
M  CHG  1   8   1
M  CHG  1  10  -1
M  END