B43MQP -OEChem-04022106553D 36 39 0 1 0 0 0 0 0999 V2000 -3.4394 0.3502 -0.9340 S 0 0 1 0 0 0 0 0 0 0 0 0 3.5153 -2.4815 0.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8338 1.6620 -1.5413 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8687 0.2348 2.2052 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1977 0.1599 -0.0418 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5629 -0.4809 -0.2429 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1127 0.8269 -0.1827 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8277 -0.6625 -0.4716 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3567 -1.6326 -0.0818 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 0.9974 0.0565 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3953 -0.1318 0.2224 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6557 0.4515 -0.6376 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8096 -1.4904 0.1579 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2381 1.9173 -0.3555 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1257 1.7331 -0.5796 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3691 -1.9562 -0.5309 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8039 -2.9182 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1975 2.2560 0.1298 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5583 -3.0759 -0.3677 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7753 -0.0096 0.4495 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5730 2.3812 0.3554 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3610 1.2494 0.5153 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9526 0.3807 0.8017 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4416 0.2389 0.9178 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5918 2.9435 -0.3187 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7421 2.6208 -0.6941 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4254 -2.1412 -0.7047 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4184 -3.8056 -0.0185 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6387 3.1800 0.0133 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9897 -4.0714 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4072 -0.8845 0.5767 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0242 3.3683 0.4056 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4281 1.3469 0.6906 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6462 1.3308 1.2484 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4816 -0.4580 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8443 0.1540 2.2669 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 12 1 0 0 0 0 1 23 1 0 0 0 0 2 13 2 0 0 0 0 4 24 1 0 0 0 0 4 36 1 0 0 0 0 5 24 2 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 7 10 1 0 0 0 0 7 14 1 0 0 0 0 8 12 2 0 0 0 0 8 16 1 0 0 0 0 9 13 1 0 0 0 0 9 17 2 0 0 0 0 10 11 1 0 0 0 0 10 18 2 0 0 0 0 11 13 1 0 0 0 0 11 20 2 0 0 0 0 12 15 1 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 26 1 0 0 0 0 16 19 2 0 0 0 0 16 27 1 0 0 0 0 17 19 1 0 0 0 0 17 28 1 0 0 0 0 18 21 1 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 20 22 1 0 0 0 0 20 31 1 0 0 0 0 21 22 2 0 0 0 0 21 32 1 0 0 0 0 22 33 1 0 0 0 0 23 24 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 M END $$$$