MMs00989678 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 53 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 1.4999 0.0127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2609 -1.2799 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0609 -1.2799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -2.5853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 -3.8779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7169 -3.9033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2168 -3.9161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9558 -5.2214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1948 -6.5141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9338 -7.8194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4337 -7.8321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1947 -6.5395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4557 -5.2342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7609 -1.2672 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 0.0382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7388 1.3308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 0.0509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9940 1.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3694 0.5757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2253 -0.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7608 -1.2417 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0218 -2.5471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5219 -2.5598 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7828 -3.8397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6007 -1.5159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5949 -0.3927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8340 0.9000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0102 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0102 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2815 1.1927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6241 0.4327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5868 -1.5639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4142 -4.3042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9152 -5.0868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0185 -2.7326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3479 -3.5152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9948 -6.5039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 -8.8535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0249 -8.8764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3947 -6.5497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0645 -4.2001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7345 2.3457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7487 -4.4485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3916 -4.8738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8169 -3.2309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 -2.6875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7894 -0.5080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 16 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 M END