NCID-ZINC04522676
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  0  0  0  0  0  0999 V2000
    0.0410    1.4250   -0.0060 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0520    0.0920   -0.0150 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9250   -0.3300   -0.0230 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0790   -0.6830   -0.0150 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9900   -2.0380   -0.0250 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1670   -2.6080   -0.0350 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3130   -0.0550   -0.0040 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3450    1.3630    0.0060 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2010    2.0410    0.0040 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5420    2.0270    0.0170 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5660   -0.8430   -0.0020 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.7280   -0.2320   -0.1060 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5190   -2.1550    0.1020 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.8640    2.0140   -0.0120 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9730   -2.0700   -0.0360 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2300   -3.5760   -0.0430 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3720    1.5320   -0.0600 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5590    2.9940    0.1030 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  9  2  0  0  0  0
  1 14  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  7  1  0  0  0  0
  5  6  1  0  0  0  0
  6 15  1  0  0  0  0
  6 16  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
  8 10  1  0  0  0  0
 10 17  1  0  0  0  0
 10 18  1  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