MMs02744207 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0077 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4922 1.5077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5077 -1.4922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7432 1.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2432 1.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2566 -1.2719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7567 -1.2797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2661 -2.3814 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.6332 -1.7643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4687 -0.2733 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9361 -2.5075 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2313 -1.7509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2235 -0.2509 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5342 -2.4941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8293 -1.7374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1322 -2.4807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1399 -3.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8448 -4.7374 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5419 -3.9941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4273 -1.7240 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0062 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0062 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1379 2.3545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8378 2.3684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1620 -2.3220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9423 -3.7075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8231 -0.5375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1823 -4.5753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5058 -4.5995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 2 0 0 0 0 20 32 1 0 0 0 0 21 22 1 0 0 0 0 22 33 1 0 0 0 0 M END