MMs01603231 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 -1.2950 -0.7570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 -0.0140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6061 1.4860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3111 2.2430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0081 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3192 3.7429 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 -0.7710 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8849 -2.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5819 -3.0140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5738 -4.5139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5657 -6.0139 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 -0.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2042 1.4720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4911 -0.7850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7941 -0.0420 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.0891 -0.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2378 -2.2916 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.7185 0.9761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7034 -2.6114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4604 -1.3164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4627 -0.1963 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.9603 -1.3245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7033 -2.6276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9463 -3.9225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4463 -3.9145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.2033 -2.6357 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0425 -0.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2885 -1.9570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6486 2.0804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0279 2.1056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0678 -2.0690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2893 -3.4008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1775 -1.8841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -3.2160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7148 -1.7001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2574 -1.7084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5659 -0.2885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5407 -4.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 3 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 26 2 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 M END