mcule 28032411472D 20 21 0 0 0 0 0 0 0 0999 V2000 -0.4458 1.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4458 0.2707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1832 -0.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1832 -1.2584 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2958 -0.2375 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0375 0.2416 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2958 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4333 1.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2833 2.3042 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 0.4083 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3082 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4542 -0.2375 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 0.2416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 1.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8374 1.1999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8374 1.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3082 -2.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4542 -1.2584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2958 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0417 -0.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 3 4 1 0 0 0 0 4 11 1 0 0 0 0 5 2 1 0 0 0 0 6 3 2 0 0 0 0 7 1 1 0 0 0 0 8 1 1 0 0 0 0 9 8 3 0 0 0 0 10 3 1 0 0 0 0 11 18 1 0 0 0 0 12 2 1 0 0 0 0 13 14 1 0 0 0 0 14 7 2 0 0 0 0 15 6 1 0 0 0 0 16 10 1 0 0 0 0 17 11 2 0 0 0 0 18 12 1 0 0 0 0 19 7 1 0 0 0 0 20 13 1 0 0 0 0 13 5 2 0 0 0 0 15 16 2 0 0 0 0 M END > P-514790 $$$$