ASINEX-ZINC00095632
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
   -0.0160    1.3680    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
    1.2230   -0.5570   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4380    0.6400   -0.0180 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.2400    1.9260    0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5210    3.3060    0.0050 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8350    3.7440   -0.0050 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1210    5.1480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3480    6.2610    0.0040 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9070    2.7950   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7570    2.0420   -0.0320 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4820   -2.0150   -0.0230 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.5500   -2.8000   -0.0180 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6270   -2.4300   -0.0360 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.9260    1.9500    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9020   -0.5950    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7130    4.0220    0.0170 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 15  1  0  0  0  0
  2  3  2  0  0  0  0
  2 16  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
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 17  1  0  0  0  0
  7  8  1  0  0  0  0
  7 10  1  0  0  0  0
  8  9  3  0  0  0  0
 10 11  3  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
M  CHG  1  12   1
M  CHG  1  14  -1
M  END