MMs01013497 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 0.7549 -1.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2549 -1.2906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0097 -2.5868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2646 -3.8886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7646 -3.8943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0098 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4902 -2.6037 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2353 -3.9055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4805 -5.2018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7353 -3.9112 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1353 -2.8719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4902 -2.6150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4804 -5.2130 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8652 -6.5810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5633 -7.3262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8697 -8.7945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3609 -8.9569 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.9761 -7.5889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2780 -6.8438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9716 -5.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9795 -4.2645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4455 -4.5819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5213 -2.8362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5292 -1.7252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0195 -5.1848 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 0.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6039 1.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -0.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 -0.2491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2097 -2.5823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1685 -4.9357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0941 -1.5667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4532 -2.0111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0941 -1.5780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5272 -3.2189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4689 -6.8340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0634 -9.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3724 -7.3360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6405 -0.9189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3355 -0.8365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4180 -2.5315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END