MMs00399859 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 1.3048 -0.7399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9028 -0.7197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9145 -2.2196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6213 -2.9797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3165 -2.2398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9446 -4.4445 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1486 -5.3425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4375 -4.5897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 -3.2146 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1976 -5.8828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4577 -7.1877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2178 -8.4808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7178 -8.4692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4576 -7.1643 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6976 -5.8712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4375 -4.5663 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9374 -4.5547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6773 -3.2498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9172 -1.9567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1772 -3.2382 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9373 -4.5313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4373 -4.5197 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.6373 -4.5197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1771 -3.2149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4171 -1.9217 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.8171 -0.8825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9171 -1.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1570 -0.6169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1973 -5.8129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5919 1.0439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0439 0.5919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5919 -1.0439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5887 1.2202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9374 -0.1116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -2.8479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2578 -7.1970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6259 -9.5247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3258 -9.5037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7382 -5.7380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0682 -4.9563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8129 -4.9505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1549 -5.7115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1024 -3.9790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0904 -2.4364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7863 -1.5317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1163 -0.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2008 -1.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7489 0.4270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1131 -0.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1628 -6.4209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8054 -6.8474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2319 -5.2048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 29 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 31 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END