B5YV6E -OEChem-04022100422D 46 49 0 0 0 0 0 0 0999 V2000 7.2746 0.7845 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 -2.7843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.2399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -3.7601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9176 0.2745 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0641 -1.2326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1923 0.2640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.2601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -2.2601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -0.7255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -1.2601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.7601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -2.2601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -1.2393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.7601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -2.7948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -2.2809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4144 0.2745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -0.7255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -2.7948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.2393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 -0.7360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2631 1.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1923 -3.7843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1232 2.2944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3913 2.2743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1117 3.2943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3797 3.2743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2399 3.7843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4188 -3.4147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1957 0.8546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8051 0.1598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -3.4147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -0.9272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -2.5930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3843 0.5907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5723 -3.7819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1899 -4.4042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8123 -3.7866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6637 1.9906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8580 1.9582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5998 -0.9206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6450 3.6105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8393 3.5780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2328 4.4042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 24 1 0 0 0 0 2 17 1 0 0 0 0 2 25 1 0 0 0 0 3 12 2 0 0 0 0 4 15 2 0 0 0 0 5 19 1 0 0 0 0 5 37 1 0 0 0 0 6 23 1 0 0 0 0 6 43 1 0 0 0 0 7 23 2 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 8 12 1 0 0 0 0 9 15 1 0 0 0 0 9 16 2 0 0 0 0 10 14 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 19 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 14 17 2 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 21 2 0 0 0 0 20 22 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 26 28 1 0 0 0 0 26 41 1 0 0 0 0 27 29 2 0 0 0 0 27 42 1 0 0 0 0 28 30 2 0 0 0 0 28 44 1 0 0 0 0 29 30 1 0 0 0 0 29 45 1 0 0 0 0 30 46 1 0 0 0 0 M END $$$$