ACROSORGANICS-ZINC01666580
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 21 20  0  0  1  0  0  0  0  0999 V2000
   -0.0220    1.8100    0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.7610   -0.4740    1.1080 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8770   -0.3920   -1.5390 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9820   -1.9100   -1.6980 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7200   -2.2370   -2.9980 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.2190   -1.7460   -3.8330 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7160   -3.7280   -3.2160 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6930   -4.3820   -2.9360 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0000    2.1870    0.0040 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5500    2.1710   -0.8710 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5330    2.1610    0.9090 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3270    0.0240   -2.3840 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8770    0.0400   -1.5080 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5320   -2.3260   -0.8540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0180   -2.3420   -1.7290 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1360   -0.7530   -2.8260 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6280   -4.3300   -3.7210 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1060   -1.7580   -2.9080 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5910   -2.1990   -2.1410 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6730   -5.2880   -3.8430 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 10  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4 13  1  0  0  0  0
  4 14  1  0  0  0  0
  5  6  1  0  0  0  0
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6 19  1  0  0  0  0
  8  9  2  0  0  0  0
  8 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 21  1  0  0  0  0
 19 20  1  0  0  0  0
M  END