HMDB0002730
     RDKit          3D
Nicotinamide N-oxide
 16 16  0  0  0  0  0  0  0  0999 V2000
    2.7636    0.2961    0.1480 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7933   -0.7023   -0.0719 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1641   -1.8736   -0.2803 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3810   -0.3946   -0.0604 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6057   -1.3346   -0.2699 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9147   -0.9107   -0.2331 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2968    0.3899   -0.0007 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3149    1.2862    0.2004 N   0  0  0  0  0  4  0  0  0  0  0  0
   -1.6856    2.5853    0.4329 O   0  0  0  0  0  1  0  0  0  0  0  0
   -0.0253    0.9128    0.1725 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6853    0.3091   -0.3793 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6585    1.0863    0.8314 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3144   -2.3670   -0.4548 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6959   -1.6377   -0.3957 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3497    0.7002    0.0231 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7572    1.6545    0.3379 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  1  0
  8 10  2  0
 10  4  1  0
  1 11  1  0
  1 12  1  0
  5 13  1  0
  6 14  1  0
  7 15  1  0
 10 16  1  0
M  CHG  2   8   1   9  -1
M  END