L3EAU1 -OEChem-05032301012D 39 40 0 0 0 0 0 0 0999 V2000 4.3159 3.5352 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1294 1.7081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5471 1.0036 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2578 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -1.6700 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9538 0.0901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -0.7189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -1.6700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -0.7189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1349 1.8126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5526 1.1082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7281 2.7262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9092 4.4488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4970 5.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3845 -0.3559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4678 0.4368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2647 -1.8616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0016 -0.2173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6174 1.7248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 1.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4877 0.4916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2974 3.1722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2141 2.3795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.4478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.4478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4785 4.8948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3952 4.1021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -5.0678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.0678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.8778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9986 4.8934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8614 5.7594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9954 5.6222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 16 1 0 0 0 0 2 10 2 0 0 0 0 3 6 1 0 0 0 0 3 10 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 11 1 0 0 0 0 5 9 2 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 23 1 0 0 0 0 9 24 1 0 0 0 0 10 13 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 17 1 0 0 0 0 14 30 1 0 0 0 0 15 18 2 0 0 0 0 15 31 1 0 0 0 0 16 20 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 19 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 M END $$$$