MMs02487633 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 57 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 -0.0021 -1.5000 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0421 -2.0986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0364 -2.1014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3001 0.7482 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8981 0.7447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4962 0.7411 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4570 1.3411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7922 -1.5107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0943 0.7376 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0142 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4315 -0.6142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6924 0.7340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6944 2.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9945 2.9822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9965 4.4822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6985 5.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3985 4.4858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3964 2.9858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3902 -1.5142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0902 -2.2624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6883 -2.2660 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6862 -3.7660 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6862 -4.9660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3861 -4.5142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9842 -4.5178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9822 -6.0178 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3017 1.9482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8255 -0.9218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3682 -0.9239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1281 1.6650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6707 1.6629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4235 -0.9253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9662 -0.9274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0959 1.9376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1012 -0.3942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8744 0.9408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0329 2.3808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0366 5.0808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7002 6.4340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3600 5.0872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3564 2.3872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7283 -1.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7876 -3.4742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3461 -5.1128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9847 -5.5543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 0.7518 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2964 1.9518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3381 0.1532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2843 -3.7696 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.4983 2.2411 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.6983 2.2395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4999 3.4411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2983 2.2427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 50 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 54 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 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 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 54 57 1 0 0 0 0 M CHG 1 2 1 M CHG 1 53 -1 M CHG 1 54 1 M END