B1GDO5 -OEChem-04012114112D 56 60 0 0 0 0 0 0 0999 V2000 6.3981 -1.7500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 4.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7942 4.7742 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 4.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -4.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -3.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -2.7153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -4.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -4.7847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -2.7153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -4.7847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0241 2.7153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0241 4.7847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9301 3.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9301 4.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9429 -3.3353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5411 -2.6455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8196 -2.2363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0214 -2.2456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5411 -4.8545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9429 -4.1647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0214 -5.2544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8196 -5.2637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1291 -1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -2.0954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -5.4046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -2.9171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -4.5829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9951 0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4762 1.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8747 1.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8612 2.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0169 2.0954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0169 5.4046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4659 2.9171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3324 4.4662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 2 0 0 0 0 2 27 1 0 0 0 0 2 33 1 0 0 0 0 3 28 2 0 0 0 0 4 34 1 0 0 0 0 4 56 1 0 0 0 0 5 33 2 0 0 0 0 6 15 2 0 0 0 0 6 18 1 0 0 0 0 7 16 1 0 0 0 0 7 23 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 48 1 0 0 0 0 9 28 1 0 0 0 0 9 51 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 13 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 14 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 15 1 0 0 0 0 13 16 2 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 20 2 0 0 0 0 19 21 1 0 0 0 0 19 44 1 0 0 0 0 20 22 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 29 2 0 0 0 0 25 28 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 31 1 0 0 0 0 29 33 1 0 0 0 0 29 52 1 0 0 0 0 30 32 2 0 0 0 0 30 53 1 0 0 0 0 31 34 2 0 0 0 0 31 54 1 0 0 0 0 32 34 1 0 0 0 0 32 55 1 0 0 0 0 M END $$$$