PUBCHEM-ZINC05116484
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 31 32  0  0  0  0  0  0  0  0999 V2000
   -0.0180    1.5030    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
    0.0220   -0.7700    1.0580 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0360   -2.0550    0.6730 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0240   -2.0860   -0.6740 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0030   -0.7850   -1.1000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0300   -0.3260   -2.4900 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4030   -0.1460   -2.9960 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3760    0.3130   -4.3870 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3510    1.6130   -4.8130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3320    1.5820   -6.1590 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3440    0.2980   -6.5450 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.3760   -0.4680   -5.4890 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3290   -0.1710   -7.9330 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0330   -3.2940   -1.5290 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0520   -4.4000   -1.0190 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0210   -3.1820   -2.7410 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0040    1.8800    0.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5460    1.8640   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5290    1.8540    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0540   -2.9140    1.3270 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5430   -1.0650   -3.1070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5580    0.6250   -2.5490 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9150    0.5920   -2.3800 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9310   -1.0980   -2.9380 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3480    2.4950   -4.1890 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3100    2.4410   -6.8140 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3960   -1.5480   -5.4950 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3530   -0.2740   -8.2920 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8280   -1.1380   -7.9840 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7970    0.5480   -8.5540 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 18  1  0  0  0  0
  1 19  1  0  0  0  0
  1 20  1  0  0  0  0
  2  3  2  0  0  0  0
  2  6  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4 21  1  0  0  0  0
  5  6  1  0  0  0  0
  5 15  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7 22  1  0  0  0  0
  7 23  1  0  0  0  0
  8  9  1  0  0  0  0
  8 24  1  0  0  0  0
  8 25  1  0  0  0  0
  9 10  1  0  0  0  0
  9 13  1  0  0  0  0
 10 11  2  0  0  0  0
 10 26  1  0  0  0  0
 11 12  1  0  0  0  0
 11 27  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 13 28  1  0  0  0  0
 14 29  1  0  0  0  0
 14 30  1  0  0  0  0
 14 31  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
M  CHG  1  12   1
M  CHG  1  15   1
M  CHG  1  17  -1
M  END