B2I5GY -OEChem-04012114352D 55 59 0 0 0 0 0 0 0999 V2000 12.3969 -1.2872 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.1204 2.7010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.2872 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4561 1.2124 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.7872 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8133 -2.0919 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.2872 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1240 0.4681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8133 -0.4825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4776 1.0062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7668 2.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8098 1.7504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0989 2.9072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3969 -1.2872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.7872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.2872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.7872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3969 -1.2872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.2872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.7872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.2872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8969 -0.4212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8969 -2.1532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.7872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.7128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8969 -0.4212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8969 -2.1532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3969 -1.2872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.2872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.2128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.7128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.7872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6709 0.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5065 0.9560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9512 0.6785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7089 0.4309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3137 1.8709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1493 2.6508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2628 2.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4272 1.2625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6253 3.2348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8677 3.4824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.3328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.9072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.0972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5869 0.1158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5869 -2.6902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 1.0228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2069 0.1158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2069 -2.6902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.8328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.9072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 3 32 2 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 5 9 1 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 6 14 1 0 0 0 0 6 15 2 0 0 0 0 7 32 1 0 0 0 0 7 54 1 0 0 0 0 7 55 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 14 2 0 0 0 0 10 12 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 13 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 18 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 20 1 0 0 0 0 17 21 1 0 0 0 0 18 22 2 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 24 1 0 0 0 0 21 25 2 0 0 0 0 22 26 1 0 0 0 0 22 46 1 0 0 0 0 23 27 2 0 0 0 0 23 47 1 0 0 0 0 24 29 2 0 0 0 0 24 32 1 0 0 0 0 25 30 1 0 0 0 0 25 48 1 0 0 0 0 26 28 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 29 31 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 M END $$$$