B1TUK9 -OEChem-04022102582D 50 52 0 0 0 0 0 0 0999 V2000 2.0000 1.5086 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 1.2298 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2601 2.7686 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 2.7686 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -2.7702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3733 0.5815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -1.7702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1165 1.2506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4223 0.8905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 0.2298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5691 1.8176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5202 1.5086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0675 0.9416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -1.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -1.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -0.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -0.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2144 1.8687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6791 0.2214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2633 2.1777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7281 0.5304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -3.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -3.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 1.8176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8107 1.6107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2231 -2.4602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0822 0.0341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8619 0.1998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4075 1.7981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6279 1.6323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7764 0.3942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5561 0.5599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 -1.5802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -1.5802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 0.0398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 0.0398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6751 2.2835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8080 -0.3851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1344 2.7841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2673 0.1155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 -2.7333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 -3.5802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 -3.8072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3161 -3.8072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -3.5802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9361 -2.7333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2255 1.1500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2714 2.0256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3958 2.0715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8956 3.2702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 2 0 0 0 0 2 10 1 0 0 0 0 2 11 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 11 2 0 0 0 0 4 24 1 0 0 0 0 4 50 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 5 26 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 14 2 0 0 0 0 7 15 1 0 0 0 0 8 13 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 18 2 0 0 0 0 9 19 1 0 0 0 0 10 16 2 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 12 20 2 0 0 0 0 12 21 1 0 0 0 0 13 25 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 16 1 0 0 0 0 14 33 1 0 0 0 0 15 17 2 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 18 20 1 0 0 0 0 18 37 1 0 0 0 0 19 21 2 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 M END $$$$