PUBCHEM-ZINC05836823
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 21  0  0  1  0  0  0  0  0999 V2000
    0.0250    1.2150   -0.0730 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0170   -0.0860   -0.1410 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4450   -0.4450   -0.0320 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.6610   -0.9620    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0800    0.8860   -0.0760 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2400    1.8580   -0.0250 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4190    0.9880   -0.2510 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9100    0.0610   -1.0160 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1950   -0.9460   -1.6270 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9900   -1.2170   -1.2060 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2020   -2.1940   -1.7480 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5630   -3.0900   -2.8330 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3780   -4.0500   -3.0890 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6270   -3.8670   -2.3340 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9060    1.8020   -0.0880 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9940    0.0740   -1.2180 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2450   -2.3650   -1.4080 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7670   -2.5200   -3.7450 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4470   -3.6770   -2.5650 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5570   -4.8940   -4.0120 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  1 15  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3 10  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  8 16  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 17  1  0  0  0  0
 12 13  1  0  0  0  0
 12 18  1  0  0  0  0
 12 19  1  0  0  0  0
 13 14  2  0  0  0  0
 13 20  1  0  0  0  0
M  CHG  1  20  -1
M  END