@MOLECULE FDBD02097 37 36 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.3411 -8.2569 -0.7163 C.3 1 UNK -0.0538 2 C1 -1.5741 -7.5160 -0.1951 C.3 1 UNK 0.0214 3 S -1.3923 -5.7397 -0.5152 S.O 1 UNK 0.0323 4 O -1.3481 -5.5132 -1.9173 O.2 1 UNK -0.2564 5 C2 -2.9249 -5.0442 0.1616 C.3 1 UNK 0.0778 6 S1 -2.8483 -3.2330 0.0943 S.3 1 UNK -0.0606 7 P -3.4435 -2.8042 -1.8947 P.3 1 UNK 0.2305 8 S2 -2.1643 -3.4594 -3.0809 S.2 1 UNK 0.0032 9 O1 -4.8616 -3.5054 -2.1936 O.3 1 UNK -0.3206 10 C3 -5.0035 -4.9094 -2.4187 C.3 1 UNK 0.0608 11 C4 -5.9346 -5.5041 -1.3602 C.3 1 UNK -0.0385 12 C5 -5.5957 -5.1457 -3.8095 C.3 1 UNK -0.0385 13 O2 -3.5826 -1.2111 -2.0816 O.3 1 UNK -0.3206 14 C6 -2.6075 -0.2831 -1.6019 C.3 1 UNK 0.0608 15 C7 -2.1351 0.6027 -2.7565 C.3 1 UNK -0.0385 16 C8 -3.2286 0.5904 -0.5100 C.3 1 UNK -0.0385 17 H -0.4483 -9.3046 -0.5275 H 1 UNK 0.0238 18 H1 0.5319 -7.8920 -0.2168 H 1 UNK 0.0238 19 H2 -0.2446 -8.0922 -1.7691 H 1 UNK 0.0238 20 H3 -1.6706 -7.6807 0.8577 H 1 UNK 0.0398 21 H4 -2.4471 -7.8809 -0.6946 H 1 UNK 0.0398 22 H5 -3.0411 -5.3588 1.1777 H 1 UNK 0.0519 23 H6 -3.7578 -5.3877 -0.4156 H 1 UNK 0.0519 24 H7 -4.0444 -5.3795 -2.3548 H 1 UNK 0.0595 25 H8 -6.8936 -5.0339 -1.4241 H 1 UNK 0.0255 26 H9 -5.5205 -5.3389 -0.3875 H 1 UNK 0.0255 27 H10 -6.0408 -6.5554 -1.5287 H 1 UNK 0.0255 28 H11 -6.5548 -4.6756 -3.8734 H 1 UNK 0.0255 29 H12 -5.7019 -6.1970 -3.9780 H 1 UNK 0.0255 30 H13 -4.9446 -4.7298 -4.5498 H 1 UNK 0.0255 31 H14 -1.7734 -0.8186 -1.1989 H 1 UNK 0.0595 32 H15 -2.9692 1.1382 -3.1596 H 1 UNK 0.0255 33 H16 -1.7008 -0.0082 -3.5201 H 1 UNK 0.0255 34 H17 -1.4050 1.2976 -2.3973 H 1 UNK 0.0255 35 H18 -4.0627 1.1259 -0.9131 H 1 UNK 0.0255 36 H19 -2.4985 1.2853 -0.1508 H 1 UNK 0.0255 37 H20 -3.5590 -0.0291 0.2975 H 1 UNK 0.0255 @BOND 1 1 2 1 2 2 3 1 3 3 4 2 4 3 5 1 5 5 6 1 6 6 7 1 7 7 8 2 8 7 9 1 9 7 13 1 10 9 10 1 11 10 11 1 12 10 12 1 13 13 14 1 14 14 15 1 15 14 16 1 16 1 17 1 17 1 18 1 18 1 19 1 19 2 20 1 20 2 21 1 21 5 22 1 22 5 23 1 23 10 24 1 24 11 25 1 25 11 26 1 26 11 27 1 27 12 28 1 28 12 29 1 29 12 30 1 30 14 31 1 31 15 32 1 32 15 33 1 33 15 34 1 34 16 35 1 35 16 36 1 36 16 37 1