ACROSORGANICS-ZINC04269455
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 16 16  0  0  0  0  0  0  0  0999 V2000
   -0.0160    1.3560    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
    1.2040   -0.7040   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4360   -0.0580   -0.0210 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5140    1.3000   -0.0140 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2660    2.0860    0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2940    3.3940    0.0080 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3900    3.9950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7530    4.7420   -0.0090 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.1710   -2.1840   -0.0210 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0160   -2.8170   -0.0130 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2970   -2.8670   -0.0350 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.9540    1.8920    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9300   -0.5490    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3430   -0.6430   -0.0320 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4740    1.7940   -0.0200 H   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 13  1  0  0  0  0
  2  3  2  0  0  0  0
  2 14  1  0  0  0  0
  3  4  1  0  0  0  0
  3 10  1  0  0  0  0
  4  5  2  0  0  0  0
  4 15  1  0  0  0  0
  5  6  1  0  0  0  0
  5 16  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  2  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
M  CHG  1  10   1
M  CHG  1  12  -1
M  END