HMDB0243615
     RDKit          3D
(4-Carbamimidoylphenyl)methanesulfonyl fluoride
 23 23  0  0  0  0  0  0  0  0999 V2000
   -3.5390   -1.2961   -0.4009 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9419   -0.2436    0.0219 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6441    0.7758    0.7164 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5019   -0.1227   -0.2348 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8103   -1.0925   -0.9008 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5418   -0.9930   -1.1493 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2043    0.1330   -0.7023 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6545    0.3193   -0.9268 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6250   -0.3508    0.4002 S   0  0  0  0  0  6  0  0  0  0  0  0
    3.3278   -1.8050    0.5041 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3677    0.3887    1.6865 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2427   -0.0671    0.0084 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.5064    1.1138   -0.0291 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8471    0.9954    0.2097 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5601   -1.3960   -0.2264 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9460    1.6672    0.2684 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9023    0.6841    1.7404 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3355   -1.9921   -1.2587 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0954   -1.7722   -1.6838 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9508   -0.1823   -1.8560 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8616    1.4153   -1.0603 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0028    2.0182    0.3378 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3527    1.8029    0.7485 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  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
  9 10  2  0
  9 11  2  0
  9 12  1  0
  7 13  1  0
 13 14  2  0
 14  4  1  0
  1 15  1  0
  3 16  1  0
  3 17  1  0
  5 18  1  0
  6 19  1  0
  8 20  1  0
  8 21  1  0
 13 22  1  0
 14 23  1  0
M  END