mcule 28032420442D 19 20 0 0 0 0 0 0 0 0999 V2000 -1.3790 -4.6729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0698 -3.7220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1188 -3.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1188 -2.4129 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0698 -2.1040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -1.1528 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7099 -0.4096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2683 -0.6176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0189 0.5413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3496 1.2844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6587 2.2356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0105 2.9787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9885 2.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6577 3.5138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3487 4.4650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3705 4.6729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2987 3.9298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2767 4.1377 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.6577 -2.9128 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 12 17 2 0 0 0 0 17 18 1 0 0 0 0 5 19 2 0 0 0 0 2 19 1 0 0 0 0 M END > MCULE-2054470408 $$$$