B5RXH6 -OEChem-04022104562D 33 35 0 0 0 0 0 0 0999 V2000 4.6660 -0.9031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 1.1211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9176 -1.9377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4144 2.1315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 2.0969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 -0.9273 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.5969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.5969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.4031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.4031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.0969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 1.1316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -0.9378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -0.9378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 0.6177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 1.1316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -0.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.6177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0641 0.6244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0574 -2.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4188 -1.5577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 1.7515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -0.7360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.9298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9478 2.4477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1938 -1.5472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7562 0.0863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6022 0.3165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3720 1.1625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7413 -1.9144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5241 -2.7639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3736 -2.9810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 2 15 1 0 0 0 0 2 20 1 0 0 0 0 3 14 1 0 0 0 0 3 21 1 0 0 0 0 4 12 1 0 0 0 0 4 26 1 0 0 0 0 5 11 2 0 0 0 0 6 17 1 0 0 0 0 6 27 1 0 0 0 0 7 9 2 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 8 16 1 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 12 15 2 0 0 0 0 13 17 2 0 0 0 0 13 22 1 0 0 0 0 14 18 2 0 0 0 0 15 17 1 0 0 0 0 16 19 2 0 0 0 0 16 23 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 25 1 0 0 0 0 20 28 1 0 0 0 0 20 29 1 0 0 0 0 20 30 1 0 0 0 0 21 31 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 M END $$$$