MMs00434096 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 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 1.2965 -0.7544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8945 -0.7633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0178 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4926 -0.7722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4875 -2.2722 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0906 -0.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5541 1.4557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0224 1.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7680 0.4609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7605 -0.6504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2592 0.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8646 -1.0734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3559 -1.2353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2417 -0.0248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6363 1.3476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1450 1.5095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5221 2.5581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9167 3.9305 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 18.7329 -0.1867 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.7993 1.4733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8045 2.9733 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6036 1.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0372 0.6036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6036 -1.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8299 0.9130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3725 0.9077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 -1.6799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6627 -1.6852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2002 1.1822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0865 -1.9811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6651 2.2617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5143 2.8571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1560 -2.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8402 -2.3332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6607 2.6074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0133 2.3962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 2 0 0 0 0 24 25 3 0 0 0 0 M CHG 1 22 -1 M END