@MOLECULE FDBD02080 32 31 0 0 0 SMALL USER_CHARGES @ATOM 1 C 0.5213 -8.7317 -2.7921 C.3 1 UNK -0.0306 2 C1 -0.7460 -8.1688 -2.1454 C.3 1 UNK 0.0897 3 O -0.5644 -6.7536 -1.8763 O.3 1 UNK -0.4643 4 C2 -1.5918 -6.1051 -1.3055 C.2 1 UNK 0.3176 5 O1 -2.6091 -6.7003 -1.0396 O.2 1 UNK -0.2499 6 C3 -1.4764 -4.6347 -0.9964 C.3 1 UNK 0.1020 7 S -2.9337 -4.0976 -0.0592 S.3 1 UNK -0.0298 8 P -2.5429 -4.8303 1.8914 P.3 1 UNK 0.3917 9 O2 -3.5780 -4.3294 2.8231 O.2 1 UNK -0.2458 10 O3 -2.5691 -6.4400 1.8753 O.3 1 UNK -0.3005 11 C4 -3.7475 -7.1964 1.5902 C.3 1 UNK 0.0549 12 C5 -3.4235 -8.6902 1.6582 C.3 1 UNK -0.0410 13 O4 -1.0940 -4.3219 2.3753 O.3 1 UNK -0.3005 14 C6 -0.7877 -2.9444 2.6007 C.3 1 UNK 0.0549 15 C7 0.6990 -2.8001 2.9317 C.3 1 UNK -0.0410 16 H 0.3875 -9.7746 -2.9904 H 1 UNK 0.0262 17 H1 1.3499 -8.5983 -2.1284 H 1 UNK 0.0262 18 H2 0.7128 -8.2158 -3.7098 H 1 UNK 0.0262 19 H3 -0.9375 -8.6847 -1.2277 H 1 UNK 0.0694 20 H4 -1.5746 -8.3022 -2.8091 H 1 UNK 0.0694 21 H5 -1.4165 -4.0817 -1.9105 H 1 UNK 0.0496 22 H6 -0.5948 -4.4605 -0.4157 H 1 UNK 0.0496 23 H7 -4.0997 -6.9521 0.6098 H 1 UNK 0.0562 24 H8 -4.5043 -6.9624 2.3096 H 1 UNK 0.0562 25 H9 -2.6667 -8.9241 0.9388 H 1 UNK 0.0252 26 H10 -4.3058 -9.2566 1.4447 H 1 UNK 0.0252 27 H11 -3.0714 -8.9345 2.6386 H 1 UNK 0.0252 28 H12 -1.3724 -2.5782 3.4186 H 1 UNK 0.0562 29 H13 -1.0134 -2.3801 1.7201 H 1 UNK 0.0562 30 H14 0.9247 -3.3644 3.8123 H 1 UNK 0.0252 31 H15 0.9284 -1.7687 3.1005 H 1 UNK 0.0252 32 H16 1.2837 -3.1663 2.1138 H 1 UNK 0.0252 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 2 5 4 6 1 6 6 7 1 7 7 8 1 8 8 9 2 9 8 10 1 10 8 13 1 11 10 11 1 12 11 12 1 13 13 14 1 14 14 15 1 15 1 16 1 16 1 17 1 17 1 18 1 18 2 19 1 19 2 20 1 20 6 21 1 21 6 22 1 22 11 23 1 23 11 24 1 24 12 25 1 25 12 26 1 26 12 27 1 27 14 28 1 28 14 29 1 29 15 30 1 30 15 31 1 31 15 32 1