B75UQB -OEChem-04022107042D 45 49 0 0 0 0 0 0 0999 V2000 11.8551 1.9002 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -0.5692 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -3.1624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 -0.6624 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -1.6624 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5911 -1.9672 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1747 -1.1624 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3154 1.4028 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -0.1624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -0.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -2.1624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 -1.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5911 -0.3577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -2.1624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9017 0.5928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -0.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -2.1624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8533 0.9002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -0.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.1624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -1.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9045 2.2109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -0.1624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5972 3.1624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 0.8321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 1.0400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1774 0.3125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3803 0.3125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7008 -0.0798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3022 -0.7701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3803 -2.6374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1774 -2.6374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7177 -0.3524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -2.7824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3543 0.5349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 0.4576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 -1.9724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1872 3.3530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4066 3.7524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0072 2.9719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9389 1.2470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2478 1.6064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 0.1092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 23 1 0 0 0 0 2 24 1 0 0 0 0 2 28 1 0 0 0 0 3 14 2 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 12 2 0 0 0 0 7 13 2 0 0 0 0 8 15 1 0 0 0 0 8 23 2 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 21 1 0 0 0 0 17 35 1 0 0 0 0 18 22 2 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 20 24 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 25 1 0 0 0 0 24 26 2 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 2 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 M END $$$$