NCID-ZINC01692074
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 21  0  0  0  0  0  0  0  0999 V2000
   -0.0130    1.3680    0.0080 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0120   -0.0290   -0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2620   -0.6600   -0.0150 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4730    0.0420   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4290    1.4550   -0.0110 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1810    2.0970    0.0030 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1260    3.5620    0.0130 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0070    4.0970    0.0240 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1960    4.1870    0.0100 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.5090   -0.9380   -0.0340 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9210   -2.1860   -0.0380 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5670   -2.0050   -0.0260 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8840   -2.7490   -0.0250 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9480   -0.6950   -0.0440 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3480    0.5130   -0.0400 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.9800    1.8670    0.0190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9100   -0.6020    0.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3630    2.0130   -0.0150 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3610   -3.1740   -0.0470 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7110   -1.7140   -0.0570 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 16  1  0  0  0  0
  2  3  2  0  0  0  0
  2 17  1  0  0  0  0
  3  4  1  0  0  0  0
  3 12  1  0  0  0  0
  4  5  2  0  0  0  0
  4 10  1  0  0  0  0
  5  6  1  0  0  0  0
  5 18  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
 10 11  2  0  0  0  0
 10 14  1  0  0  0  0
 11 12  1  0  0  0  0
 11 19  1  0  0  0  0
 12 13  1  0  0  0  0
 14 15  1  0  0  0  0
 14 20  2  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  CHG  1  15  -1
M  END