BL83EU -OEChem-04012115442D 48 52 0 0 0 0 0 0 0999 V2000 4.6660 3.5670 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -0.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 3.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1660 4.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 4.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.5670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.0670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 3.0670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0241 0.0323 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 3.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 3.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 1.5323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0241 2.1016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.0878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9301 1.5878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9301 0.5462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -3.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -3.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -4.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 4.2216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 0.9124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0169 2.7216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 3.3999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 1.7341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7407 -1.5407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3422 -0.8504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4659 1.8999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4659 0.2341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 3.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7272 -2.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5331 -2.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7272 -4.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5331 -4.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -5.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 9 1 0 0 0 0 1 13 1 0 0 0 0 2 8 1 0 0 0 0 2 24 1 0 0 0 0 3 16 1 0 0 0 0 3 43 1 0 0 0 0 6 18 2 0 0 0 0 7 12 1 0 0 0 0 7 14 1 0 0 0 0 7 33 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 9 12 2 0 0 0 0 10 17 1 0 0 0 0 10 27 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 19 2 0 0 0 0 14 20 2 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 15 21 1 0 0 0 0 19 22 1 0 0 0 0 19 34 1 0 0 0 0 20 23 1 0 0 0 0 20 35 1 0 0 0 0 21 25 2 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 24 26 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 27 1 0 0 0 0 25 41 1 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 27 42 1 0 0 0 0 28 30 1 0 0 0 0 28 44 1 0 0 0 0 29 31 2 0 0 0 0 29 45 1 0 0 0 0 30 32 2 0 0 0 0 30 46 1 0 0 0 0 31 32 1 0 0 0 0 31 47 1 0 0 0 0 32 48 1 0 0 0 0 M END $$$$