IBS-ZINC04028951
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  0  0  0  0  0  0999 V2000
   -0.1960    1.4990   -0.0050 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0370    0.0090   -0.0030 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1390   -0.7200    1.1910 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0060   -2.1220    1.2170 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2590   -2.7940    0.0060 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3650   -2.0910   -1.2020 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2140   -0.6910   -1.1850 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3170    0.0100   -2.3700 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6350   -2.7740   -2.5150 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6980   -1.9660   -3.5110 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.1090   -2.8800    2.5240 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3370   -2.1960    3.5730 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.7170    1.9770   -0.3760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0400    1.7900   -0.6380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3870    1.8850    1.0020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3350   -0.1980    2.1270 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3740   -3.8780    0.0070 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4980   -0.7000   -3.0770 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7730   -4.0330   -2.5450 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0300   -4.1430    2.4850 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  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 16  1  0  0  0  0
  4  5  1  0  0  0  0
  4 11  1  0  0  0  0
  5  6  2  0  0  0  0
  5 17  1  0  0  0  0
  6  7  1  0  0  0  0
  6  9  1  0  0  0  0
  7  8  1  0  0  0  0
  8 18  1  0  0  0  0
  9 10  1  0  0  0  0
  9 19  2  0  0  0  0
 11 12  1  0  0  0  0
 11 20  2  0  0  0  0
M  CHG  1  10  -1
M  CHG  1  12  -1
M  END