NCID-ZINC04797569
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 19 19  0  0  0  0  0  0  0  0999 V2000
   -0.0380    1.3120    0.1300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0080   -0.1140    0.0560 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5980   -0.6610   -1.0240 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1560    0.1520   -1.9990 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7740   -0.4110   -3.0990 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8450   -1.7920   -3.2440 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3060   -2.6170   -2.3030 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6730   -2.0700   -1.1660 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1480   -2.8680   -0.2380 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4930   -2.3940    0.6820 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3890   -4.0850   -2.4700 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.8470   -4.5570   -3.4960 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9990   -4.8220   -1.5820 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.9820    1.6970    0.1410 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5670    1.7100   -0.7360 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5510    1.6180    1.0420 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1080    1.2260   -1.8980 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2060    0.2280   -3.8540 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3310   -2.2140   -4.1110 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3  8  1  0  0  0  0
  4  5  1  0  0  0  0
  4 17  1  0  0  0  0
  5  6  2  0  0  0  0
  5 18  1  0  0  0  0
  6  7  1  0  0  0  0
  6 19  1  0  0  0  0
  7  8  2  0  0  0  0
  7 11  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
M  CHG  1  11   1
M  CHG  1  13  -1
M  END