D0K3HY -OEChem-10191522492D 43 45 0 0 0 0 0 0 0999 V2000 5.5443 0.2520 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.6279 1.9227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6279 -3.2734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.0567 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6279 0.1907 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 2.8120 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 1.8614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.0567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.5567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 1.0567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.5567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 1.0567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6279 0.1907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.0567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1279 -0.6753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6279 -1.5414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1279 -0.6753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1279 -2.4074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6279 -1.5414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1279 -2.4074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6279 -3.2734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.8667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2105 0.4027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5202 0.8013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 3.0567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.6767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 3.0567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3179 -0.3463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4616 2.9398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4409 3.2734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.5936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.2533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.4802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0079 -1.5414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4379 -0.1384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8179 -2.9443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2479 -1.5414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6279 -3.8934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2479 -3.2734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6279 -2.6534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 14 2 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 10 1 0 0 0 0 4 13 2 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 5 31 1 0 0 0 0 6 8 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 2 0 0 0 0 8 11 2 0 0 0 0 9 12 2 0 0 0 0 9 16 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 18 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 21 1 0 0 0 0 19 37 1 0 0 0 0 20 22 2 0 0 0 0 20 38 1 0 0 0 0 21 23 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 M END $$$$