MMs00030647 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 62 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 1.5000 -0.0058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 1.2904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 2.5923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 3.8884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7649 3.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5099 2.5808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 1.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 -1.3134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 -2.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9900 -2.6211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7450 -1.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2289 -1.1064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6768 0.3252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3238 -2.1316 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6779 -1.4864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9138 -2.3364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7955 -3.8331 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7955 -5.0331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4414 -4.4784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2055 -3.6283 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.2055 -4.8283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9631 -4.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1804 -5.9530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5319 -4.0198 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0314 -4.6831 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3855 -4.0378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5037 -2.5425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6214 -4.8879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5032 -6.3832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7391 -7.2332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0932 -6.5880 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.2114 -5.0926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9755 -4.2426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5199 5.1788 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0046 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0046 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 2.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 4.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7099 2.5762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 -1.3088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 -3.6523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6039 1.0139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9814 -0.5092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5193 -0.6308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4118 -1.2446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0755 -2.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1379 -5.4555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6000 -5.3340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7117 -4.8957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9368 -5.8794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4199 -6.8994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6445 -8.4295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2947 -4.5764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0701 -3.0463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 46 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 28 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 55 1 0 0 0 0 33 34 1 0 0 0 0 33 56 1 0 0 0 0 34 35 2 0 0 0 0 35 36 1 0 0 0 0 35 57 1 0 0 0 0 36 58 1 0 0 0 0 M END