LJI9F8 -OEChem-05032301112D 43 46 0 1 0 0 0 0 0999 V2000 2.4988 -1.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1926 2.2085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1936 -2.1947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2954 0.8568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7874 -0.1085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5576 -2.1673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4294 -0.6432 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7874 -2.1778 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5633 -0.1432 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6556 -0.5483 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9885 0.1887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4603 0.8455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4818 1.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4493 -1.5268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1281 1.5898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1711 2.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8175 2.5404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 2.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2954 -0.1432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1614 -0.6432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0274 -0.1432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1614 -1.6432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8935 -0.6432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8935 -1.6432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0274 -2.1432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6935 -0.6224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6935 -1.6640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5312 -0.7624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1379 -0.9379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4855 0.5513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5751 -0.2734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4294 -1.2632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7348 1.4620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2315 3.0018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6464 3.3359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -2.4442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.7978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0274 0.4768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6245 -1.9532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0274 -2.7632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7802 -2.7978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3043 -0.7285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9025 -0.0387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 36 1 0 0 0 0 2 16 1 0 0 0 0 2 37 1 0 0 0 0 3 14 2 0 0 0 0 4 19 2 0 0 0 0 5 23 1 0 0 0 0 5 26 1 0 0 0 0 6 27 2 0 0 0 0 9 7 1 1 0 0 0 7 19 1 0 0 0 0 7 32 1 0 0 0 0 8 24 1 0 0 0 0 8 27 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 1 0 0 0 10 29 1 0 0 0 0 11 13 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 16 1 0 0 0 0 15 17 2 0 0 0 0 15 33 1 0 0 0 0 16 18 2 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 38 1 0 0 0 0 22 25 2 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M END $$$$