MMs00453044 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 52 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 -0.0062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4938 -1.5062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5062 1.4938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0124 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7446 -1.3145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9892 -2.6105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2446 -1.3207 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9892 -2.6229 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5892 -3.6621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2338 -3.9188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9785 -5.2209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2231 -6.5168 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9677 -7.8190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4892 -2.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2338 -3.9312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2446 -1.3331 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2553 1.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7553 1.2587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 -0.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7445 -1.3393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5106 2.5547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7660 3.8568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0025 0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0025 -0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8938 -1.5037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4888 -2.7062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6938 -1.5111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7062 1.4888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5111 2.6938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9062 1.4963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8489 -0.2840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3178 -3.1436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3114 -4.6863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9009 -4.4534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8945 -5.9960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9260 -8.4147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5634 -8.8607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0094 -7.2233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5775 -0.7985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5839 0.7441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1294 1.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4686 2.4458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9553 1.2587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4223 0.7241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4160 -0.8185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5313 -2.5202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8705 -1.7544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0106 2.5485 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6149 3.5852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 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 22 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 51 1 0 0 0 0 51 52 1 0 0 0 0 M END