MMs01991719 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 42 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 0.7410 1.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2410 1.3145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2589 -1.2835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7589 -1.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2703 -2.3913 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6363 -1.7717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4693 -0.2811 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9405 -2.5128 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2344 -1.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2240 -0.2539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5385 -2.4948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8324 -1.7359 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.1365 -2.4769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3036 -3.9676 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7730 -4.2693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5140 -2.9652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5026 -1.8574 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8044 -0.3881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6828 0.6079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9845 2.0773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4079 2.5506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5295 1.5546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2277 0.0853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9528 2.0280 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1339 2.3392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8338 2.3579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1661 -2.3372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9488 -3.7127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7735 -3.4194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3162 -3.4088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2686 -5.3622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7065 -2.8315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5441 0.2292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0872 2.8741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6493 3.7261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1250 -0.7115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 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 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 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 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 39 1 0 0 0 0 M END