IFLAB-ZINC04517654
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 26 27  0  0  0  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
   -1.7090   -0.4240    0.0160 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0970   -1.7620    0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4270   -2.0910    0.0240 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3960   -1.0830    0.0390 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0040    0.2600    0.0430 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6720    0.5830    0.0360 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8280   -1.4340    0.0500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1680   -2.6020    0.0460 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7600   -0.4610    0.0650 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1090   -0.7920    0.0750 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0840    0.0640    0.0900 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3090   -0.4270    0.0980 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3730   -1.7600    0.0900 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7270   -2.3860    0.0640 S   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
   -1.3480   -2.5400    0.0010 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7270   -3.1290    0.0200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7500    1.0410    0.0540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3680    1.6200    0.0430 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4890    0.4700    0.0680 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1880    0.2000    0.1100 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.2770   -2.3510    0.0950 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 17  1  0  0  0  0
  1 18  1  0  0  0  0
  1 19  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  8  2  0  0  0  0
  4  5  2  0  0  0  0
  4 20  1  0  0  0  0
  5  6  1  0  0  0  0
  5 21  1  0  0  0  0
  6  7  2  0  0  0  0
  6  9  1  0  0  0  0
  7  8  1  0  0  0  0
  7 22  1  0  0  0  0
  8 23  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 24  1  0  0  0  0
 12 13  2  0  0  0  0
 12 16  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 25  1  0  0  0  0
 15 16  1  0  0  0  0
 15 26  1  0  0  0  0
M  END