MMs02601177 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 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 1.3022 -0.7444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9003 -0.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9067 -2.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6109 -2.9889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3086 -2.2444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2089 -2.9778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5047 -2.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8777 -2.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1958 -4.2923 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8766 -1.7075 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1210 -0.4116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7253 0.9613 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.6552 -0.7298 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3690 -1.8579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2455 -0.6406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7379 -0.7910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3539 -2.1587 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6144 0.4263 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.1069 0.2759 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.5069 1.3151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7228 -1.0918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2153 -1.2423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8312 -2.6100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0917 -0.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9834 1.4931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3674 2.8608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5956 1.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0418 0.5956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5956 -1.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5929 1.2111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9369 -0.1289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 -4.1889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -2.8489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2141 -4.1778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0432 -3.0128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4498 -2.3793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1647 -0.1192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5713 0.5143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1217 1.5204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5597 -1.3871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8116 -2.2886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4153 -1.2423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7371 -3.1027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3240 -3.7041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9254 -2.1172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0656 -0.7262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7929 0.9489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1179 0.6762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4758 1.3427 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 M CHG 1 51 -1 M END