NCID-ZINC05432873
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.3810    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3230   -0.3960   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1040    0.6880   -0.0140 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3310    1.7990   -0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7800    3.1030    0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2190    3.3830   -0.0110 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0690    2.4060   -0.0240 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.1720    2.6200   -0.0330 N   0  3  0  0  0  0  0  0  0  0  0  0
    6.2760    2.8350   -0.0420 N   0  5  0  0  0  0  0  0  0  0  0  0
    1.8010   -1.7970   -0.0240 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.9340   -2.7890   -0.0200 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0930   -2.0520   -0.0380 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.8900    2.0160    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8590   -0.6560    0.0070 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0710    3.9180    0.0120 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5710    4.4040   -0.0090 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  2  0  0  0  0
  1 14  1  0  0  0  0
  2  3  2  0  0  0  0
  2 15  1  0  0  0  0
  3  4  1  0  0  0  0
  3 11  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 16  1  0  0  0  0
  7  8  1  0  0  0  0
  7 17  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  2  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
M  CHG  1   9   1
M  CHG  1  10  -1
M  CHG  1  11   1
M  CHG  1  13  -1
M  END