L6SU4D -OEChem-05022322472D 49 49 0 1 0 0 0 0 0999 V2000 2.4440 -2.2290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 -2.2290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3100 -2.4610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3100 -3.4610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3100 -1.4610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 1.7710 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.7290 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 -0.7290 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3100 0.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 0.7710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 2.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0420 2.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 -0.7290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 3.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0420 3.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 3.7710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8100 -1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 -1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 -1.7290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3100 -2.4610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3100 -2.4610 0.0000 B 0 5 0 0 0 0 0 0 0 0 0 0 3.0980 0.8536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6994 0.1634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3881 0.1884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7866 0.8787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6994 2.3787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 1.6884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2541 1.6884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6526 2.3787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8926 -0.5169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2023 -0.1184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 3.8536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6994 3.1634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6526 3.1634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2541 3.8536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5746 4.2460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7775 4.2460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2274 -1.8070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9177 -2.2056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3926 -1.3829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7023 -0.9844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.1920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.2659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7274 -2.6731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4177 -3.0716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 -2.8490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6200 -2.9980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7731 -3.7710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8469 -1.1510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 46 1 0 0 0 0 2 19 2 0 0 0 0 3 21 1 0 0 0 0 3 47 1 0 0 0 0 4 21 1 0 0 0 0 4 48 1 0 0 0 0 5 21 1 0 0 0 0 5 49 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 8 7 1 1 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 14 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 15 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 17 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 16 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 20 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 M CHG 1 21 -1 M END $$$$