BIO5X9 -OEChem-04022107082D 46 50 0 0 0 0 0 0 0999 V2000 9.3684 0.4181 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.4899 -0.0090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4899 -1.6185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0320 -0.2205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.2271 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5823 -1.9316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8411 1.1808 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8629 1.3887 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 -1.1226 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.7970 0.9135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7861 1.1226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8025 0.8090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5437 -0.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5437 -1.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8116 -0.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6776 0.1862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2038 1.8271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3848 0.1045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7806 1.2271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1983 1.9316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3794 0.2091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6776 -1.8138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8116 -1.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -0.1045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0735 -0.8138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9456 0.1862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2147 1.6180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 -0.2091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2202 1.5135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3629 0.5226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8135 0.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6776 0.8062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8393 2.3287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1326 -0.4619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3379 1.4989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6097 1.8231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4505 2.4980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7438 -0.2925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6776 -2.4338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2747 -1.6238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7602 -0.6061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5344 -1.2285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5344 -0.3990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4669 2.1844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8558 2.0151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1969 0.5352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 30 1 0 0 0 0 2 13 1 0 0 0 0 2 25 1 0 0 0 0 3 14 1 0 0 0 0 3 25 1 0 0 0 0 4 26 1 0 0 0 0 4 30 1 0 0 0 0 5 9 1 0 0 0 0 6 9 2 0 0 0 0 7 8 1 0 0 0 0 7 26 2 0 0 0 0 8 30 2 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 17 2 0 0 0 0 10 18 1 0 0 0 0 11 19 1 0 0 0 0 11 20 2 0 0 0 0 11 21 1 0 0 0 0 12 24 2 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 22 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 15 26 1 0 0 0 0 16 32 1 0 0 0 0 17 20 1 0 0 0 0 17 33 1 0 0 0 0 18 21 2 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 24 28 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 27 29 2 0 0 0 0 27 44 1 0 0 0 0 28 31 2 0 0 0 0 29 31 1 0 0 0 0 29 45 1 0 0 0 0 31 46 1 0 0 0 0 M CHG 2 5 -1 9 1 M END $$$$