NCID-ZINC03871479
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  0  0  0  0  0  0999 V2000
   -0.1250    1.2600   -0.5280 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0680   -0.1310   -0.6530 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1210   -0.7960   -0.3650 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2480   -0.0910    0.0420 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1870    1.2990    0.1690 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9960    1.9860   -0.1030 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9770    3.4490    0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1050    4.1820    0.7120 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1870    5.5990    0.7360 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2810    6.7560    0.7350 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0090    3.5690    1.5570 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6780    3.2510    2.7340 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.2210   -2.1540   -0.4750 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3500   -2.5040   -0.7250 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0570    1.7720   -0.7630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9550   -0.6680   -0.9740 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1700   -0.6200    0.2620 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0730    1.8400    0.4920 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7720    3.9450   -0.5530 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1290    3.4770    0.9750 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 15  1  0  0  0  0
  2  3  2  0  0  0  0
  2 16  1  0  0  0  0
  3  4  1  0  0  0  0
  3 13  1  0  0  0  0
  4  5  2  0  0  0  0
  4 17  1  0  0  0  0
  5  6  1  0  0  0  0
  5 18  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7 19  1  0  0  0  0
  8  9  1  0  0  0  0
  8 11  1  0  0  0  0
  9 10  3  0  0  0  0
 11 12  1  0  0  0  0
 11 20  2  0  0  0  0
 13 14  1  0  0  0  0
M  CHG  1  12  -1
M  END