MMs01496554 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 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 1.3049 -0.7397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9029 -0.7192 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1841 1.5410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5009 -0.6987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0616 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0989 -0.6782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2675 -2.1687 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7371 -2.4689 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4768 -1.1640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4644 -0.0572 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7646 1.4124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6420 2.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9423 3.8769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9673 -0.9954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5666 0.3797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0571 0.5482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9483 -0.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3491 -2.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8586 -2.2020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4388 -0.4897 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0095 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0345 -0.6082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3144 -1.9397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8194 0.9337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3621 0.9458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9124 -1.9192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7369 -1.6240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2795 -1.6118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8808 0.9717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3925 2.4350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5037 2.0274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0806 4.2567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0442 4.6728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8536 1.3449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5365 1.6483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0621 -2.9986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3792 -3.3020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 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 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 M END