MMs01596160 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 51 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 0.2083 -1.4855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -2.4086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5989 -2.0478 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7504 -2.8963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8072 -3.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7812 -1.1247 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1718 -1.6870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3801 -3.1725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3541 -0.7639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7447 -1.3262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9270 -0.4031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7187 1.0824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3176 -0.9654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5259 -2.4509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9165 -3.0132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0988 -2.0901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8905 -0.6046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 -0.0423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4894 -2.6524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6717 -1.7293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4634 -0.2438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6457 0.6793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0363 0.1170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2446 -1.3685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0623 -2.2916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2706 -3.7771 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 17.6612 -4.3394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0883 -4.7002 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 18.2186 1.0401 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1884 0.1666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1666 1.1884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1884 -0.1666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9508 -1.1749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7125 -1.4628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9198 -3.1471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2355 -3.3544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6188 -3.6999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9739 -4.7216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9956 -3.3666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6146 0.0637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4626 0.0394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9903 0.2536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5801 -3.1894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0832 -4.2016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8364 0.1339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3333 1.1461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3509 0.2060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4791 1.8677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3571 -1.8184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 30 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END