B0QIS4 -OEChem-04022103032D 38 39 0 1 0 0 0 0 0999 V2000 5.4897 -3.3475 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 5.0298 0.1351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 -1.6249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4608 0.4442 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9019 -2.5385 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0774 -4.1565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6806 -3.9353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2987 -2.7597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2208 4.7229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2208 1.7229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9529 1.7229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0868 3.2229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7208 -0.8159 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4118 0.1351 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7208 -0.8159 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2208 0.7229 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3086 -1.6249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0868 2.2229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3548 2.2229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3548 3.2229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2208 3.7229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8189 2.2229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0023 -1.3684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9734 -0.3033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3332 -0.7189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6684 1.0044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8226 -1.9716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7393 -1.1790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5164 -1.5601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8179 1.9129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8179 3.5329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9529 1.1029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1289 1.6860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3558 2.5329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5089 2.7598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8253 -4.7229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7454 -4.5519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 1 8 2 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 13 3 1 1 0 0 0 3 29 1 0 0 0 0 14 4 1 1 0 0 0 4 30 1 0 0 0 0 5 17 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 9 21 2 0 0 0 0 16 10 1 6 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 18 1 0 0 0 0 11 22 1 0 0 0 0 11 33 1 0 0 0 0 12 18 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 15 17 1 6 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 19 20 2 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 M END $$$$