PUBCHEM-ZINC06814163
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 30 31  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
    0.0230   -0.6990    1.1980 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0420   -2.0780    1.1980 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0400   -2.7730   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0190   -2.0660   -1.2170 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0060   -0.6860   -1.2020 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0160   -2.7940   -2.5050 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.0020   -2.1750   -3.5540 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0330   -4.0110   -2.5170 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.0600   -4.2500   -0.0210 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9280   -5.0380    0.6790 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6030   -6.3660    0.3900 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4610   -6.3340   -0.4860 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7760   -5.0410   -0.7150 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1360   -7.4970   -1.0620 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7650   -8.6190   -0.7760 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1720   -7.3250   -1.9100 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7840   -8.5050   -2.4340 C   0  0  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
    0.0250   -0.1600    2.1350 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0580   -2.6200    2.1330 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0270   -0.1380   -2.1320 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7170   -4.6980    1.3340 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0920   -7.2480    0.7760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1740   -9.1070   -1.6140 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6000   -8.2260   -3.1010 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0440   -9.0820   -2.9890 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 20  1  0  0  0  0
  1 21  1  0  0  0  0
  1 22  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 23  1  0  0  0  0
  4  5  1  0  0  0  0
  4 24  1  0  0  0  0
  5  6  2  0  0  0  0
  5 11  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7 25  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 11 12  2  0  0  0  0
 11 15  1  0  0  0  0
 12 13  1  0  0  0  0
 12 26  1  0  0  0  0
 13 14  2  0  0  0  0
 13 27  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 28  1  0  0  0  0
 19 29  1  0  0  0  0
 19 30  1  0  0  0  0
M  CHG  1   8   1
M  CHG  1  10  -1
M  END