NCID-ZINC04783136
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
   -0.0150    1.2870    0.0090 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2000   -0.6740   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4030   -1.7650    0.8320 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6100   -2.4350    0.8120 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6170   -2.0260   -0.0440 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4220   -0.9450   -0.8840 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2180   -0.2710   -0.8780 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9080   -2.7490   -0.0600 N   0  3  0  0  0  0  0  0  0  0  0  0
    5.0830   -3.7010    0.6800 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7970   -2.3910   -0.8120 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.9120    1.8390    0.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9580    1.8140    0.0160 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6180   -2.0850    1.5010 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7680   -3.2800    1.4660 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2120   -0.6310   -1.5500 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0650    0.5700   -1.5380 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  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
  3  4  1  0  0  0  0
  3  8  2  0  0  0  0
  4  5  2  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
  6  7  2  0  0  0  0
  6  9  1  0  0  0  0
  7  8  1  0  0  0  0
  7 16  1  0  0  0  0
  8 17  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
M  CHG  1   9   1
M  CHG  1  11  -1
M  END