COMPND HMDB0240465 HETATM 1 C1 UNL 1 -3.039 -0.898 -1.192 1.00 0.00 C HETATM 2 C2 UNL 1 -2.299 0.065 -0.352 1.00 0.00 C HETATM 3 C3 UNL 1 -2.912 1.238 0.074 1.00 0.00 C HETATM 4 C4 UNL 1 -2.204 2.127 0.859 1.00 0.00 C HETATM 5 O1 UNL 1 -2.825 3.184 1.216 1.00 0.00 O HETATM 6 O2 UNL 1 -0.965 1.918 1.228 1.00 0.00 O HETATM 7 C5 UNL 1 -0.356 0.819 0.842 1.00 0.00 C HETATM 8 C6 UNL 1 0.947 0.597 1.228 1.00 0.00 C HETATM 9 C7 UNL 1 1.581 -0.547 0.827 1.00 0.00 C HETATM 10 O3 UNL 1 2.895 -0.756 1.226 1.00 0.00 O HETATM 11 S1 UNL 1 4.156 -0.174 0.223 1.00 0.00 S HETATM 12 O4 UNL 1 5.070 -1.276 -0.168 1.00 0.00 O HETATM 13 O5 UNL 1 4.937 0.810 1.041 1.00 0.00 O HETATM 14 O6 UNL 1 3.514 0.635 -1.111 1.00 0.00 O HETATM 15 C8 UNL 1 0.929 -1.467 0.047 1.00 0.00 C HETATM 16 C9 UNL 1 -0.371 -1.277 -0.357 1.00 0.00 C HETATM 17 C10 UNL 1 -0.995 -0.113 0.060 1.00 0.00 C HETATM 18 H1 UNL 1 -2.900 -1.907 -0.765 1.00 0.00 H HETATM 19 H2 UNL 1 -2.781 -0.832 -2.269 1.00 0.00 H HETATM 20 H3 UNL 1 -4.141 -0.680 -1.075 1.00 0.00 H HETATM 21 H4 UNL 1 -3.930 1.426 -0.219 1.00 0.00 H HETATM 22 H5 UNL 1 1.447 1.350 1.855 1.00 0.00 H HETATM 23 H6 UNL 1 3.691 0.159 -1.959 1.00 0.00 H HETATM 24 H7 UNL 1 1.425 -2.392 -0.285 1.00 0.00 H HETATM 25 H8 UNL 1 -0.873 -2.010 -0.973 1.00 0.00 H CONECT 1 2 18 19 20 CONECT 2 3 3 17 CONECT 3 4 21 CONECT 4 5 5 6 CONECT 6 7 CONECT 7 8 8 17 CONECT 8 9 22 CONECT 9 10 15 15 CONECT 10 11 CONECT 11 12 12 13 13 CONECT 11 14 CONECT 14 23 CONECT 15 16 24 CONECT 16 17 17 25 END