MMs02245358 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 42 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 -0.7454 1.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2454 1.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 0.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2545 -1.2911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7546 -1.2964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2454 1.3175 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8454 2.3567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4909 2.6139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9909 2.6086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 0.0263 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.1000 1.0656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 0.0316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7545 -1.2648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2545 -1.2595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9999 0.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2454 1.3385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7454 1.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4999 0.0474 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.7545 -1.2753 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -6.0091 -2.5770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1418 2.3388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5436 1.8276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8582 -2.3282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1582 -2.3377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3979 -0.5754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0645 -0.1874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1582 -2.3061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8581 -2.2967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8417 2.3799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1417 2.3704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2363 3.9155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7454 1.3227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3417 2.3641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4529 -0.5299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0562 -2.0208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0604 -3.2208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9343 -0.8317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6326 4.9526 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 35 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 12 35 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 34 41 1 0 0 0 0 35 36 1 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 M END