B5OTE7 -OEChem-04012115522D 47 49 0 0 0 0 0 0 0999 V2000 4.5981 -1.6845 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 -2.5506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 -0.8185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7260 -2.6845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0278 3.6171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7387 2.4604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1845 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1424 -3.4893 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4315 -0.7231 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.1845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.1845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -3.1845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.6845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1424 -1.8798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.1845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.6845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7260 -2.6845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4530 -0.9293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7422 0.2275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0744 0.9718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7207 0.4337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3850 1.9223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0314 1.3842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3635 2.1285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7172 2.6666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.0645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -3.4945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.3045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3350 -4.0786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.6476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.8745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -1.7215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -2.6845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.3045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -2.6845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0390 -0.4678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0360 -3.2215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4677 0.8439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1348 -0.0278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6380 1.5121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5561 2.7178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6138 4.0786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 7 1 0 0 0 0 1 11 1 0 0 0 0 4 18 1 0 0 0 0 4 42 1 0 0 0 0 5 28 1 0 0 0 0 5 47 1 0 0 0 0 6 28 2 0 0 0 0 7 13 1 0 0 0 0 7 31 1 0 0 0 0 8 12 1 0 0 0 0 8 18 1 0 0 0 0 8 34 1 0 0 0 0 9 21 2 0 0 0 0 9 22 1 0 0 0 0 10 12 2 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 11 14 2 0 0 0 0 11 16 1 0 0 0 0 12 17 1 0 0 0 0 13 19 1 0 0 0 0 13 20 1 0 0 0 0 13 29 1 0 0 0 0 14 30 1 0 0 0 0 15 18 2 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 23 25 2 0 0 0 0 23 43 1 0 0 0 0 24 26 1 0 0 0 0 24 44 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 M END $$$$