MDPI-ZINC03847498
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  0  0  0  0  0  0999 V2000
   -0.0660    1.5020    0.0150 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0210   -0.0050    0.0040 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1050   -0.7190    1.1830 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1430   -2.1010    1.1360 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0620   -2.7470   -0.0120 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.0590   -2.1120   -1.1610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1100   -0.7170   -1.1980 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2510   -0.0050   -2.4840 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1840    1.2080   -2.5180 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1060   -4.1620   -0.0100 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.9300    1.8970   -0.1850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7560    1.8500   -0.7540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4050    1.8480    0.9910 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1730   -0.2030    2.1290 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2410   -2.6600    2.0550 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1220   -2.6750   -2.0800 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4540   -0.7000   -3.6200 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5400   -0.1900   -4.4380 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 11  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  7  2  0  0  0  0
  3  4  2  0  0  0  0
  3 14  1  0  0  0  0
  4  5  1  0  0  0  0
  4 15  1  0  0  0  0
  5  6  2  0  0  0  0
  5 10  1  0  0  0  0
  6  7  1  0  0  0  0
  6 16  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 17  1  0  0  0  0
 17 18  1  0  0  0  0
M  CHG  1   5   1
M  CHG  1  10  -1
M  END