B1S8UO -OEChem-04012118192D 40 44 0 0 0 0 0 0 0999 V2000 4.7771 2.1860 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7817 -3.7955 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7851 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -2.7609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 0.7391 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4710 1.9370 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -2.7609 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9435 3.7955 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 0.2391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -0.7609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3039 0.3340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4992 1.7278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 -1.2609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9718 1.0783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 -2.2609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 -1.2609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6146 -0.6165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7549 2.3956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 -0.7263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9503 0.8721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 -2.2609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 -2.7956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5931 -0.8228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2610 -0.0785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -1.2401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -2.2817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8577 3.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2756 3.0512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3181 0.8217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9196 0.1314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9331 -0.9509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2005 -1.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 -0.1063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -3.3809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3644 1.3335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7857 -1.4121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8676 -0.2063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3284 -0.9280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3941 3.7013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6589 3.1150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 28 1 0 0 0 0 2 22 1 0 0 0 0 3 26 1 0 0 0 0 4 21 2 0 0 0 0 5 9 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 6 12 2 0 0 0 0 6 14 1 0 0 0 0 7 15 1 0 0 0 0 7 21 1 0 0 0 0 7 34 1 0 0 0 0 8 27 1 0 0 0 0 8 28 2 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 13 1 0 0 0 0 10 16 2 0 0 0 0 11 14 1 0 0 0 0 11 17 2 0 0 0 0 12 18 1 0 0 0 0 13 15 2 0 0 0 0 13 19 1 0 0 0 0 14 20 2 0 0 0 0 15 22 1 0 0 0 0 16 21 1 0 0 0 0 16 31 1 0 0 0 0 17 23 1 0 0 0 0 17 32 1 0 0 0 0 18 27 2 0 0 0 0 19 25 2 0 0 0 0 19 33 1 0 0 0 0 20 24 1 0 0 0 0 20 35 1 0 0 0 0 22 26 2 0 0 0 0 23 24 2 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 27 39 1 0 0 0 0 28 40 1 0 0 0 0 M END $$$$