MMs01917414 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 1.2402 -0.8438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6518 -0.3364 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1326 -3.8916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5705 -1.5222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7267 -2.7623 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2865 -2.3431 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0698 -1.4758 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8595 -2.7511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3588 -2.7048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0683 -1.3832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2786 -0.1079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9881 1.2136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4874 1.2599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2772 -0.0153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5676 -1.3369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7764 0.0310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4860 1.3526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9853 1.3989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7750 0.1236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2743 0.1700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9838 1.4915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1941 2.7668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6948 2.7205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1500 -4.0727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9398 -5.3479 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6750 0.9921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9921 0.6750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 -0.9921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9906 -3.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0792 -0.1450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3563 2.2338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0550 2.3172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1994 -2.3571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3462 1.7280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6578 2.5402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2074 -0.9336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9061 -0.8503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1833 1.5286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7617 3.8241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0630 3.7407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6507 -4.1190 0.0000 O 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 5 2 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 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 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 2 0 0 0 0 M CHG 1 26 -1 M END