D05BTG -OEChem-10101305022D 45 48 0 1 0 0 0 0 0999 V2000 4.5878 -0.4120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -0.4690 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 0.3970 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5878 1.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -0.4690 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5000 1.2630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5388 0.8970 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5388 -0.1030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 1.2630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -1.3350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3479 1.4848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -1.3350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2614 1.0780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2433 2.4793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -3.0671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 -2.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0704 1.6658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0524 3.0671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -3.0671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9659 2.6604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 1.7724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0508 1.5160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 -1.0060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0826 1.4751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3923 1.8736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4418 1.5094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6678 -0.7094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1554 -0.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6077 1.8736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9174 1.4751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -1.0060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 0.7955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 -0.0015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 -2.2011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3100 -0.7981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3262 0.4614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6769 2.7315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 -3.6040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1200 -2.2011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6368 1.4137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 3.6837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3100 -3.6040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4675 3.0248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 8 1 0 0 0 0 2 5 1 0 0 0 0 2 10 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 7 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 11 1 0 0 0 0 5 25 1 0 0 0 0 6 9 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 1 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 13 36 1 0 0 0 0 14 18 2 0 0 0 0 14 37 1 0 0 0 0 15 19 1 0 0 0 0 15 38 1 0 0 0 0 16 20 2 0 0 0 0 16 39 1 0 0 0 0 17 21 2 0 0 0 0 17 40 1 0 0 0 0 18 21 1 0 0 0 0 18 41 1 0 0 0 0 19 22 2 0 0 0 0 19 42 1 0 0 0 0 20 22 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 M END $$$$