MMs01799443 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 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 0.7601 -1.2932 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0202 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4798 -2.6097 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7803 -3.8912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0404 -5.1960 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4596 -5.2077 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1995 -6.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4394 -7.8056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1793 -9.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6792 -9.1221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4393 -7.8290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6994 -6.5241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4595 -5.2310 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.2802 -3.8795 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0403 -5.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4408 -6.5477 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5633 -7.5427 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8565 -6.7826 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5332 -5.3179 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5282 -4.1954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0536 -2.7725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0487 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5183 -1.9504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9929 -3.3734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9978 -4.4959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0345 0.6081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6081 1.0345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0345 -0.6081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0676 -4.1731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2394 -7.7963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5712 -10.1450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2711 -10.1660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6393 -7.8383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8780 -2.5321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6690 -0.5116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3143 -1.0524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1685 -3.6137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3775 -5.6342 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 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 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 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 24 25 2 0 0 0 0 24 37 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 M END