L5M9WE -OEChem-05032300482D 83 87 0 1 0 0 0 0 0999 V2000 2.0000 -0.4695 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.4695 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.7734 -2.7014 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.4695 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8667 2.3366 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 4.0305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.0305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3007 -3.4640 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 4.0305 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.4695 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.4695 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1097 -2.0628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.9695 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7788 -2.8059 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2788 -3.6719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.9695 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4641 -0.4695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7078 3.6238 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.3769 4.3669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8769 5.2330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8988 5.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9157 2.6456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 3.5305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.5305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3611 -3.5104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.5305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.5305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9544 -4.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3557 -3.4059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6099 3.0057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5422 -5.2330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9434 -4.2149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.5305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5367 -5.1284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4833 -2.9324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6113 -1.6983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7997 -1.5258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -1.6595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1165 -3.3259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0872 -4.2616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8452 -3.9241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8399 -3.8789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.2795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 0.0055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 0.0055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2259 3.2336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7918 3.9062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8785 4.7314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4433 5.4851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6853 5.8226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8340 5.6416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2788 5.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.7795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.0895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2961 2.6240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8294 2.0317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.2795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 2.3405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.3405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.0895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3378 -4.4887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6078 -2.8395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0247 2.5450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0706 3.4206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1950 3.4665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.2795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2900 -5.7993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5600 -4.1501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3503 -0.0064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.2205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9703 1.0674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9011 -5.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 37 1 0 0 0 0 2 38 1 0 0 0 0 14 3 1 1 0 0 0 3 26 1 0 0 0 0 13 4 1 1 0 0 0 4 64 1 0 0 0 0 5 22 1 0 0 0 0 5 40 1 0 0 0 0 6 24 2 0 0 0 0 7 25 2 0 0 0 0 8 11 1 0 0 0 0 8 15 1 0 0 0 0 8 52 1 0 0 0 0 9 18 1 0 0 0 0 9 21 1 0 0 0 0 9 24 1 0 0 0 0 16 10 1 6 0 0 0 10 25 1 0 0 0 0 10 63 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 45 1 6 0 0 0 12 14 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 16 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 49 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 53 1 0 0 0 0 17 23 1 0 0 0 0 17 54 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 6 0 0 0 18 56 1 0 0 0 0 19 20 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 20 21 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 21 61 1 0 0 0 0 21 62 1 0 0 0 0 22 65 1 0 0 0 0 22 66 1 0 0 0 0 23 29 2 0 0 0 0 23 30 1 0 0 0 0 24 27 1 0 0 0 0 25 28 1 0 0 0 0 26 34 2 0 0 0 0 26 35 1 0 0 0 0 27 31 1 0 0 0 0 27 32 2 0 0 0 0 28 31 2 0 0 0 0 28 33 1 0 0 0 0 29 38 1 0 0 0 0 29 67 1 0 0 0 0 30 37 2 0 0 0 0 30 68 1 0 0 0 0 31 69 1 0 0 0 0 32 36 1 0 0 0 0 32 70 1 0 0 0 0 33 36 2 0 0 0 0 33 71 1 0 0 0 0 34 41 1 0 0 0 0 34 72 1 0 0 0 0 35 42 2 0 0 0 0 35 73 1 0 0 0 0 36 43 1 0 0 0 0 37 39 1 0 0 0 0 38 39 2 0 0 0 0 39 77 1 0 0 0 0 40 74 1 0 0 0 0 40 75 1 0 0 0 0 40 76 1 0 0 0 0 41 44 2 0 0 0 0 41 78 1 0 0 0 0 42 44 1 0 0 0 0 42 79 1 0 0 0 0 43 80 1 0 0 0 0 43 81 1 0 0 0 0 43 82 1 0 0 0 0 44 83 1 0 0 0 0 M END $$$$