MMs01136387 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 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 1.3046 0.7403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9026 0.7209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0388 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5006 0.7015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5118 2.2014 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0582 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9455 -0.9068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9397 -1.5511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4045 -1.8740 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.1642 -0.5806 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.7642 -1.6198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1688 0.5416 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4917 2.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9217 2.4593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3845 3.0185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9196 3.3413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9316 4.4485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6571 -0.4349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2774 0.9308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7703 1.0764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6429 -0.1436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0226 -1.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5297 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8952 -2.7294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2749 -4.0952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1358 0.0020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7562 1.3677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5922 1.0437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0437 -0.5922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5922 -1.0437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5401 1.6653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0828 1.6537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8198 -0.9329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3625 -0.9444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1382 1.6459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6808 1.6343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1870 -1.2388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7397 -1.5422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8053 -2.7436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2330 3.8670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6907 2.7867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9068 3.9848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9953 5.0039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1999 5.3996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5794 1.9069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2666 2.1690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0334 -2.7476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1823 -3.5989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7786 -5.1877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3674 -4.5914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8487 0.8715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2524 2.4603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6636 1.8640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 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 19 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 M END