HMDB0041066
     RDKit          3D
S-Propyl thiosulfate
 16 15  0  0  0  0  0  0  0  0999 V2000
   -2.2645   -1.0726   -0.6695 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6993    0.3127   -0.3695 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3920    0.0610    0.3770 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6004    1.4148    0.7133 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.5688    1.0326    0.1318 S   0  0  0  0  0  6  0  0  0  0  0  0
    2.8005    1.1850   -1.3210 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1070    2.1761    0.8985 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2623   -0.3239    0.8021 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6365   -1.1327   -1.7014 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0321   -1.3599    0.0819 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4729   -1.8598   -0.5833 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5024    0.8261   -1.3351 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4233    0.8351    0.2708 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6949   -0.5241    1.2832 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1315   -0.6999   -0.2587 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6474   -0.8705    0.0651 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  1  0
  5  6  2  0
  5  7  2  0
  5  8  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  2 13  1  0
  3 14  1  0
  3 15  1  0
  8 16  1  0
M  END