BEC8I2 -OEChem-04042106143D 53 55 0 1 0 0 0 0 0999 V2000 6.1681 2.8558 1.0108 F 0 0 0 0 0 0 0 0 0 0 0 0 4.6956 2.8285 2.6225 F 0 0 0 0 0 0 0 0 0 0 0 0 5.9740 1.0919 2.2825 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7294 -2.2722 -0.5360 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0599 -4.1862 0.4529 F 0 0 0 0 0 0 0 0 0 0 0 0 3.5064 2.6069 0.1799 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5406 -3.2777 0.7551 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7773 0.1332 0.2878 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1169 1.4931 -1.8615 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3279 3.6581 -1.4218 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6921 -1.2798 -0.1491 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1817 -0.3045 -0.1185 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8348 0.2890 -1.4105 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9164 0.7205 -0.4006 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2607 1.5080 0.7242 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8985 -0.7944 -0.8529 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5247 -0.2736 -2.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2966 2.0832 1.6802 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9932 2.5139 -1.0805 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5297 -0.5461 -0.7544 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4153 -2.0241 -0.4448 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6774 -1.5274 -0.2479 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5632 -3.0054 0.0618 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1943 -2.7570 0.1603 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6916 -2.1373 0.3298 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0664 -1.5723 0.3368 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1317 -2.3334 0.7901 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3969 -1.7565 0.7753 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5556 -0.4543 0.3141 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4267 0.2227 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8481 1.4741 -0.2018 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2361 1.9340 -0.1816 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3755 2.3137 -0.1659 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7627 2.7753 -0.1471 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6421 1.3663 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4796 -0.1269 0.0036 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5669 0.8852 1.2994 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7868 -0.6294 -3.4007 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2059 -1.1019 -2.4533 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1162 0.5038 -3.1705 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0978 0.3998 -1.0676 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6018 -3.5663 0.5623 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8855 3.7593 -2.3287 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 4.4382 -0.7777 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9927 -0.3591 -0.4625 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0111 -3.3494 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2544 -2.3252 1.1235 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4339 1.2387 -0.4945 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2529 2.1405 0.4345 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4900 1.5193 -1.2377 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8469 3.7340 0.3734 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4062 2.0535 0.3649 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1429 2.9070 -1.1646 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 18 1 0 0 0 0 3 18 1 0 0 0 0 4 21 1 0 0 0 0 5 23 1 0 0 0 0 6 15 1 0 0 0 0 6 19 1 0 0 0 0 7 25 2 0 0 0 0 8 29 1 0 0 0 0 8 31 1 0 0 0 0 9 13 1 0 0 0 0 9 19 2 0 0 0 0 10 19 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 22 1 0 0 0 0 11 25 1 0 0 0 0 11 45 1 0 0 0 0 12 26 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 18 1 0 0 0 0 15 37 1 0 0 0 0 16 20 1 0 0 0 0 16 21 2 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 20 22 2 0 0 0 0 20 41 1 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 23 24 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 30 2 0 0 0 0 30 48 1 0 0 0 0 31 32 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 32 33 3 0 0 0 0 33 34 1 0 0 0 0 34 51 1 0 0 0 0 34 52 1 0 0 0 0 34 53 1 0 0 0 0 M END $$$$