L9S4EW -OEChem-05022323472D 44 46 0 0 0 0 0 0 0999 V2000 4.4936 -3.1865 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.3080 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7320 4.3080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.8080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.8080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.8080 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.4641 -0.6920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0154 -2.5284 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.6920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.1920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.1920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6845 -1.7853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5154 -3.3944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.1920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4766 -0.8071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1087 -4.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.6180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.9980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.1880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.1180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 2.8449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.9980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 1.7710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 3.8080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.4280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 3.8080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.8120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0831 -0.6782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3477 -0.2007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8702 -0.9360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.0020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5423 -4.0558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8565 -4.8744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6751 -4.5602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 22 1 0 0 0 0 2 6 1 0 0 0 0 3 6 2 0 0 0 0 4 10 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 12 1 0 0 0 0 5 18 1 0 0 0 0 5 30 1 0 0 0 0 6 11 1 0 0 0 0 7 17 2 0 0 0 0 7 18 1 0 0 0 0 8 19 1 0 0 0 0 8 22 2 0 0 0 0 9 18 2 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 13 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 19 2 0 0 0 0 17 23 1 0 0 0 0 19 24 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 26 1 0 0 0 0 23 25 2 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M CHG 2 2 -1 6 1 M END $$$$