
  Marvin  05141019232D          

  4  3  0  0  0  0            999 V2000
   -2.7107   -0.5304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2982    0.1841    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5357   -0.5304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9482   -1.2448    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  3  4  1  0  0  0  0
M  END
$$$$

  Marvin  05141019232D          

  4  3  0  0  0  0            999 V2000
   -2.7107    0.1185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2982   -0.5959    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5357    0.1185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9482   -0.5959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  3  4  1  0  0  0  0
M  END
$$$$

  Marvin  05141019232D          

  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS 8 7 0 0 0
M  V30 BEGIN ATOM
M  V30 1 C -5.06 -0.9901 0 0 CFG=2
M  V30 2 C -3.9711 0.0989 0 0
M  V30 3 C -2.4311 0.0989 0 0
M  V30 4 N -1.3421 -0.9901 0 0 CFG=1
M  V30 5 O -6.149 0.0989 0 0
M  V30 6 Cl -5.06 -2.5301 0 0
M  V30 7 S -0.2531 0.0989 0 0
M  V30 8 C -1.3421 -2.5301 0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 2
M  V30 2 2 2 3
M  V30 3 1 3 4
M  V30 4 1 1 5
M  V30 5 1 1 6 CFG=1
M  V30 6 1 4 7
M  V30 7 1 4 8 CFG=1
M  V30 END BOND
M  V30 BEGIN COLLECTION
M  V30 MDLV30/STEABS ATOMS=(2 1 4)
M  V30 END COLLECTION
M  V30 END CTAB
M  END
$$$$
