D09AFM -OEChem-04152108492D 50 51 0 0 0 0 0 0 0999 V2000 15.9885 1.2476 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.2003 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 17.7205 1.2609 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 1.2003 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 14.2796 -1.7657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.7997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8660 -0.2722 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8506 1.7542 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8660 1.7003 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 16.4951 0.3854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4818 2.1097 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 0.3343 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 2.0663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 1.2311 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 1.2245 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3943 0.7275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.7003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4020 -0.2724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.2997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5942 0.7345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 0.7211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4963 1.2553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2241 1.2350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2565 1.2342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.2003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1263 0.7409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.7003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2719 -0.7657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.7997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5122 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2241 -0.8344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6022 -0.3071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.3205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1340 -0.2591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 0.7278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4987 1.8753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2169 1.8549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2517 1.8542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.8203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5242 -1.4339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2169 -1.4543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0689 -0.6233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6659 -0.6326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6733 -0.5649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -0.6097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7239 1.8511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9918 1.8444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8189 -2.0716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -2.1097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 10 2 0 0 0 0 1 11 2 0 0 0 0 1 26 1 0 0 0 0 2 9 1 0 0 0 0 2 12 2 0 0 0 0 2 13 2 0 0 0 0 2 27 1 0 0 0 0 5 28 1 0 0 0 0 5 49 1 0 0 0 0 6 29 1 0 0 0 0 6 50 1 0 0 0 0 7 36 2 0 0 0 0 14 20 1 0 0 0 0 14 36 1 0 0 0 0 14 47 1 0 0 0 0 15 21 1 0 0 0 0 15 36 1 0 0 0 0 15 48 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 16 24 2 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 17 25 2 0 0 0 0 18 28 2 0 0 0 0 18 30 1 0 0 0 0 19 29 2 0 0 0 0 19 31 1 0 0 0 0 20 22 2 0 0 0 0 20 32 1 0 0 0 0 21 23 2 0 0 0 0 21 33 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 24 26 1 0 0 0 0 24 39 1 0 0 0 0 25 27 1 0 0 0 0 25 40 1 0 0 0 0 26 34 2 0 0 0 0 27 35 2 0 0 0 0 28 34 1 0 0 0 0 29 35 1 0 0 0 0 30 32 2 0 0 0 0 30 41 1 0 0 0 0 31 33 2 0 0 0 0 31 42 1 0 0 0 0 32 43 1 0 0 0 0 33 44 1 0 0 0 0 34 45 1 0 0 0 0 35 46 1 0 0 0 0 M CHG 4 3 1 4 1 8 -1 9 -1 M END $$$$