MMs03856254 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 42 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 1.5000 0.0069 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 -1.2886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 -1.2817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 -2.5773 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1120 -3.6165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 -3.8798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 -5.1753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0119 -2.5703 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7559 -1.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2559 -1.2609 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2439 1.3510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7439 1.3579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4879 2.6604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9878 2.6673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7438 1.3718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9998 0.0693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4999 0.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0055 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0055 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1303 -1.7043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4698 -2.4694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5421 -0.1009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8817 -0.8661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6167 -3.6068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8607 -2.2974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8704 0.4468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2028 1.2243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2970 -1.1342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6294 -0.3567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1144 1.7562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4468 2.5337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8831 3.6969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5830 3.7093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9438 1.3773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6046 -0.9672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9047 -0.9796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 -3.8867 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 42 1 0 0 0 0 9 10 1 0 0 0 0 9 29 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 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 M CHG 1 42 -1 M END