MMs00693416 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 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 0.7582 -1.2943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0164 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7746 -3.8923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0328 -5.1960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4672 -5.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2254 -3.9112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4836 -2.6075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2418 -1.3132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7417 -1.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7253 -3.9207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4671 -5.2244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -6.4903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2909 -6.4809 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0327 -5.1771 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5327 -5.1677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2745 -3.8639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2909 -6.4619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7908 -6.4525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5490 -7.7468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8072 -9.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3073 -9.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5491 -7.7657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0490 -7.7373 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0354 0.6065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6065 1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0354 -0.6065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9745 -3.8847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0606 -6.2485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7493 -0.1227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9417 -1.3302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7342 -2.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5101 -4.6310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0606 -6.2674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4241 -5.8179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1975 -7.5333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4262 -4.1417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3843 -5.4095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4138 -10.0859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3491 -7.7733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 40 1 0 0 0 0 M END