D01MWX -OEChem-10101305022D 46 50 0 0 0 0 0 0 0999 V2000 12.6641 -0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8602 -0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2622 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2622 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7923 1.0241 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 1.0241 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 1.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5243 1.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5033 1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5243 1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0210 1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6602 0.5275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8641 0.5275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5961 0.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9282 0.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1282 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3961 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0221 1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5022 1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1282 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3961 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2622 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9282 -0.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5961 -0.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2622 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0221 -1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5022 -1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4401 1.4675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6871 0.4326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9798 2.2955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0299 2.2991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4182 1.2490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 0.4245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6343 0.4245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1061 1.2490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4944 2.2991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5445 2.2955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7899 1.6442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7344 1.6442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5094 1.6546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0150 1.6546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4639 -0.8329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0604 -0.8329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5094 -1.6546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0150 -1.6546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 14 2 0 0 0 0 3 23 2 0 0 0 0 4 26 2 0 0 0 0 5 13 1 0 0 0 0 5 16 1 0 0 0 0 5 39 1 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 6 40 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 14 1 0 0 0 0 7 29 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 15 20 2 0 0 0 0 15 25 1 0 0 0 0 16 19 2 0 0 0 0 16 24 1 0 0 0 0 17 19 1 0 0 0 0 17 21 2 0 0 0 0 17 23 1 0 0 0 0 18 20 1 0 0 0 0 18 22 2 0 0 0 0 18 23 1 0 0 0 0 19 42 1 0 0 0 0 20 41 1 0 0 0 0 21 26 1 0 0 0 0 21 27 1 0 0 0 0 22 26 1 0 0 0 0 22 28 1 0 0 0 0 24 27 2 0 0 0 0 24 43 1 0 0 0 0 25 28 2 0 0 0 0 25 44 1 0 0 0 0 27 46 1 0 0 0 0 28 45 1 0 0 0 0 M END $$$$