BJC8E2 -OEChem-04012119092D 37 39 0 1 0 0 0 0 0999 V2000 4.5928 2.9920 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4118 3.2694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.4118 2.2694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.4118 2.2694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.4608 1.5784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4118 1.2694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7208 0.3184 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4118 1.2694 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1028 0.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 -0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4118 2.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 -1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9996 2.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9941 1.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0458 -1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7778 -1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4008 1.0604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5819 2.7829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0458 -2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7778 -2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 -3.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3954 0.9558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5764 2.6784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9832 1.7648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5364 0.5705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7928 -0.2186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.1636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5088 -1.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3148 -1.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0364 0.5588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3297 3.3493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5088 -3.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3148 -3.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 -3.8894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6476 0.3894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9408 3.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5998 1.7000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 11 1 0 0 0 0 3 11 1 0 0 0 0 4 11 1 0 0 0 0 5 8 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 7 10 2 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 12 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 19 1 0 0 0 0 15 28 1 0 0 0 0 16 20 2 0 0 0 0 16 29 1 0 0 0 0 17 22 1 0 0 0 0 17 30 1 0 0 0 0 18 23 2 0 0 0 0 18 31 1 0 0 0 0 19 21 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 22 24 2 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 M END $$$$