B6SGQ3 -OEChem-04012116472D 45 47 0 1 0 0 0 0 0999 V2000 6.8981 -1.2183 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -2.5843 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.8981 -2.9503 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.0843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 0.9157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.4157 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 8.9962 1.4157 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.9157 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5321 2.4157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.4157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 2.9157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 2.4157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 0.9157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.0843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 0.8810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 1.4157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 2.9503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.5843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.5843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.3949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.4365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.5843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -1.5843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 0.9157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.0843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -2.0843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2030 0.6057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1426 2.3080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7441 2.9983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0646 3.3906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2675 3.3906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9996 0.4407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7966 0.4407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 0.2611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6626 1.8906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8656 1.8906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 3.5703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -0.2743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2631 -0.2743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 1.0828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 2.7486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2631 -1.8943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.7043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 2.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3991 1.2257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 26 1 0 0 0 0 3 26 1 0 0 0 0 4 24 2 0 0 0 0 5 7 1 0 0 0 0 5 45 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 13 1 0 0 0 0 7 24 1 0 0 0 0 7 44 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 8 27 1 0 0 0 0 9 11 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 12 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 17 2 0 0 0 0 13 16 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 20 1 0 0 0 0 15 34 1 0 0 0 0 16 24 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 21 1 0 0 0 0 17 37 1 0 0 0 0 18 22 1 0 0 0 0 18 38 1 0 0 0 0 19 23 2 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 25 2 0 0 0 0 22 26 1 0 0 0 0 23 25 1 0 0 0 0 23 42 1 0 0 0 0 25 43 1 0 0 0 0 M END $$$$