HMDB0246285
     RDKit          3D
4-(2-Aminoethyl)benzenesulfonyl fluoride
 23 23  0  0  0  0  0  0  0  0999 V2000
   -4.0746   -0.1501   -0.7522 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6558    0.1515   -0.8864 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9030   -0.6557    0.1517 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4476   -0.3687    0.0398 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1360    0.6554    0.7590 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4912    0.8619    0.6037 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2875    0.1048   -0.2259 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0123    0.4734   -0.3347 S   0  0  0  0  0  6  0  0  0  0  0  0
    4.7847   -0.7531   -0.6390 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4336    1.1181    0.9695 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2575    1.5957   -1.5679 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.7043   -0.9054   -0.9335 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3478   -1.1393   -0.8009 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2608   -0.2194    0.2758 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5985    0.6984   -1.0744 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2913   -0.0758   -1.9063 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5388    1.2298   -0.6386 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3116   -0.3929    1.1522 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1048   -1.7316   -0.0972 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4657    1.2840    1.4333 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9377    1.6805    1.1835 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3235   -1.5188   -1.5993 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0636   -1.9427   -1.3764 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  8 10  2  0
  8 11  1  0
  7 12  1  0
 12 13  2  0
 13  4  1  0
  1 14  1  0
  1 15  1  0
  2 16  1  0
  2 17  1  0
  3 18  1  0
  3 19  1  0
  5 20  1  0
  6 21  1  0
 12 22  1  0
 13 23  1  0
M  END