MMs02580733 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 49 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 1.3047 -0.7401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3161 -2.2400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6208 -2.9801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9141 -2.2203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9027 -0.7203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2188 -2.9604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5121 -2.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6576 -0.7076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1224 -0.3845 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8822 -1.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8871 -2.8001 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3752 -1.8233 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2476 -0.6031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6271 0.7626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7405 -0.7485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6129 0.4717 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.1059 0.3263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7264 -1.0394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2193 -1.1848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0917 0.0354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4712 1.4010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9783 1.5465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3578 2.9121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2302 4.1323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5921 1.0438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0438 0.5921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5921 -1.0438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2815 -2.8479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -4.1801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9373 -0.1124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5889 1.2197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4545 -3.8855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9972 -3.8737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7597 0.0886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8716 -2.9158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4185 -1.9045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8230 -1.2663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1165 1.5642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0284 -2.0155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7157 -2.2773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2861 -0.0809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1691 2.3772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2063 3.4344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9281 5.1085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2540 4.8302 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 8 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 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 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 M END