NCID-ZINC01560974
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 30 30  0  0  0  0  0  0  0  0999 V2000
   -0.0180    1.5030    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0560   -0.5940   -0.0110 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1510   -0.6910    0.0090 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0560   -2.1400    0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4610   -2.7440    0.0110 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3650   -4.2060    0.0020 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3010   -5.0220    1.0950 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2220   -6.2910    0.6380 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2360   -6.2610   -0.6970 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3270   -5.0110   -1.1010 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3770   -4.5600   -2.5000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3330   -5.4260   -3.4620 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.2340   -6.8550   -3.1570 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3810   -4.9910   -4.8090 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.3160   -4.5970    2.5130 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.3900   -3.4140    2.7930 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2530   -5.4300    3.3990 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0040    1.8800    0.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5460    1.8640   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5290    1.8540    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5270   -2.4640   -0.8960 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5100   -2.4730    0.8840 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9890   -2.4200    0.9080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0060   -2.4100   -0.8720 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1580   -7.1800    1.2480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4500   -3.5060   -2.7250 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0980   -7.1610   -2.5660 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2100   -7.4240   -4.0860 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3220   -7.0440   -2.5920 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 19  1  0  0  0  0
  1 20  1  0  0  0  0
  1 21  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5 22  1  0  0  0  0
  5 23  1  0  0  0  0
  6  7  1  0  0  0  0
  6 24  1  0  0  0  0
  6 25  1  0  0  0  0
  7  8  1  0  0  0  0
  7 11  1  0  0  0  0
  8  9  2  0  0  0  0
  8 16  1  0  0  0  0
  9 10  1  0  0  0  0
  9 26  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 27  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 28  1  0  0  0  0
 14 29  1  0  0  0  0
 14 30  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
M  CHG  1  13   1
M  CHG  1  15  -1
M  CHG  1  16   1
M  CHG  1  18  -1
M  END