Mol:KOX00420

 
  ISISHOST03240423162D 1   1.00000     0.00000  6276

 15 16  0     0  0            999 V2000
    0.0759    0.0345    0.0000 C   0  0  0  0  0  0           0  0  0
    0.7655    0.4310    0.0000 N   0  0  3  0  0  0           0  0  0
    0.0759   -0.7621    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.6103    0.4310    0.0000 N   0  0  0  0  0  0           0  0  0
    1.4552    0.0310    0.0000 C   0  0  0  0  0  0           0  0  0
    0.7655    1.2241    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.6103   -1.1621    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.3035    0.0345    0.0000 C   0  0  0  0  0  0           0  0  0
    2.1448    0.4276    0.0000 C   0  0  0  0  0  0           0  0  0
    1.4552    1.6241    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.3035   -0.7621    0.0000 N   0  3  0  0  0  0           0  0  0
   -0.6103   -1.9621    0.0000 N   0  0  0  0  0  0           0  0  0
   -1.9931    0.4310    0.0000 N   0  0  0  0  0  0           0  0  0
    2.1448    1.2241    0.0000 C   0  0  0  0  0  0           0  0  0
   -2.4552   -1.2483    0.0000 O   0  5  0  0  0  0           0  0  0
  1  2  1  0     0  0
  1  3  1  0     0  0
  1  4  2  0     0  0
  2  5  1  0     0  0
  2  6  1  0     0  0
  3  7  2  0     0  0
  4  8  1  0     0  0
  5  9  1  0     0  0
  6 10  1  0     0  0
  7 11  1  0     0  0
  7 12  1  0     0  0
  8 13  1  0     0  0
  9 14  1  0     0  0
 11 15  1  0     0  0
  8 11  2  0     0  0
 10 14  1  0     0  0
M  CHG  2  11   1  15  -1
M  END