B39XLS -OEChem-04022101222D 43 45 0 0 0 0 0 0 0999 V2000 8.2619 2.8395 0.0000 P 0 3 0 0 0 0 0 0 0 0 0 0 9.2619 2.8395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 3.7056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.3027 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 1.9122 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.1075 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.6075 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.1075 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 1.1075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -0.6478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 1.1075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.6075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -0.8540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 1.9735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.6075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 -1.8045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 1.9735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.1075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 -2.5488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 -2.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.6075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9209 -3.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 -2.9612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8994 -3.7056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3751 -0.7351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 -1.2674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 0.4969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8445 0.8954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5812 -0.7666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 -0.2343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8695 2.5841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1793 2.1856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6542 1.3629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3445 1.7614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0036 -2.4210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6707 -1.5493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.2975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5069 -3.9608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1739 -3.0891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 3.4175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 3.4175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0920 -4.2949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5719 3.3765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 17 1 0 0 0 0 2 43 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 12 1 0 0 0 0 5 9 2 0 0 0 0 5 15 1 0 0 0 0 6 12 2 0 0 0 0 6 21 1 0 0 0 0 7 18 1 0 0 0 0 7 21 2 0 0 0 0 8 18 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 11 1 0 0 0 0 10 13 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 14 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 15 1 0 0 0 0 13 16 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 17 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 18 2 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 19 22 1 0 0 0 0 19 35 1 0 0 0 0 20 23 2 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 24 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 42 1 0 0 0 0 M CHG 1 1 1 M END $$$$