NCID-ZINC04705574
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  1  0  0  0  0  0999 V2000
   -0.0190    1.5260    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.9910   -0.3820    0.2460 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9650   -0.4860    0.9940 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1090    0.1780    1.2250 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2690   -0.5000    2.2860 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.3660    1.3610    0.6420 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3990    2.0410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6670    3.0670   -0.5880 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4040   -0.4930   -1.3660 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5400   -0.8490   -1.5700 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5440    1.8880   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5270    1.8790    0.9080 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7730   -1.2950    1.4930 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2620    1.7310    0.6860 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5010   -0.5330   -2.3560 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1960   -0.8550   -3.2160 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  8  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2 10  1  0  0  0  0
  4  5  1  0  0  0  0
  4 14  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7 15  1  0  0  0  0
  8  9  2  0  0  0  0
 10 11  2  0  0  0  0
 10 16  1  0  0  0  0
 16 17  1  0  0  0  0
M  END