ACROSORGANICS-ZINC04284444
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 18  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
    1.2280   -0.7020   -0.0140 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4140    0.0380   -0.0210 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3760    1.4300   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1670    2.0900    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1320    3.5700    0.0100 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0630    4.1540    0.0240 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1720    4.2040    0.0040 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.7720   -1.0850   -0.0400 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.6610   -2.4480   -0.0370 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4400   -2.0330   -0.0230 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1480   -4.1420   -0.0500 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9620    1.8910    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9280   -0.5530    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2980    1.9930   -0.0180 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8810   -4.7610   -0.0420 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 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 12  1  0  0  0  0
  4  5  2  0  0  0  0
  4 10  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
  7  9  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
 13 17  1  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  END