MMs02002036 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 1.5000 -0.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2426 -1.3117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7426 -1.3202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7573 1.2778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2573 1.2863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5147 2.5896 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2720 3.8843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0147 2.5980 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7572 1.2609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7426 -1.3371 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2425 -1.3456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1173 -2.5641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5465 -2.1087 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5133 -2.8195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5550 -0.6087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1310 -0.1371 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.8275 1.3319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9478 2.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3718 1.8577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6754 0.3887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6458 -3.9881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2166 -4.4435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2081 -5.9435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6321 -6.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5206 -5.2065 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0068 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0068 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6368 -2.3476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3367 -2.3628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3631 2.3137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1367 -2.3730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6883 1.7091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7050 3.5044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2681 2.6556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8145 0.0114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2498 -3.7327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2333 -6.6433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9964 -7.5584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 27 2 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M CHG 1 19 1 M END