BC3SD6 -OEChem-04022106102D 46 50 0 0 0 0 0 0 0999 V2000 4.6783 -4.8144 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 0.0590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1563 2.0586 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9209 0.5971 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.0097 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.5097 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0097 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -3.2050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -2.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.5097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -4.0097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.5097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1606 3.0527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2101 3.3633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2101 1.7539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 -0.3534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 -1.5101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -2.0482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6265 2.5586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.0097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6318 -0.5596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 -1.0977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -4.0097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8994 0.8033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9049 3.7205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0039 4.3418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6987 4.6990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7482 5.0097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.5097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7144 -1.6380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3815 -2.5097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6566 1.6924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0065 2.5586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2177 -0.0981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8848 -0.9698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -4.6297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8819 -4.0097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -3.3897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5069 1.0586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4942 3.5279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4146 4.5344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1602 5.1131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6203 5.6164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.8197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.6997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.6997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 24 2 0 0 0 0 3 13 1 0 0 0 0 3 15 1 0 0 0 0 3 32 1 0 0 0 0 4 16 1 0 0 0 0 4 24 1 0 0 0 0 4 39 1 0 0 0 0 5 12 2 0 0 0 0 5 29 1 0 0 0 0 6 20 1 0 0 0 0 6 29 2 0 0 0 0 7 20 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 2 0 0 0 0 9 17 2 0 0 0 0 9 18 1 0 0 0 0 10 12 1 0 0 0 0 10 20 2 0 0 0 0 11 23 1 0 0 0 0 13 14 1 0 0 0 0 13 25 2 0 0 0 0 14 19 1 0 0 0 0 14 26 2 0 0 0 0 15 19 2 0 0 0 0 15 24 1 0 0 0 0 16 21 2 0 0 0 0 16 22 1 0 0 0 0 17 21 1 0 0 0 0 17 30 1 0 0 0 0 18 22 2 0 0 0 0 18 31 1 0 0 0 0 19 33 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 25 27 1 0 0 0 0 25 40 1 0 0 0 0 26 28 1 0 0 0 0 26 41 1 0 0 0 0 27 28 2 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 29 44 1 0 0 0 0 M END $$$$