MMs02998668 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 36 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 1.5000 -0.0104 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2409 -1.3147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 1.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5181 2.5876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7590 1.2729 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 2.5667 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1180 1.5274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7771 3.8709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4728 3.1300 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.0361 5.1751 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.0813 4.6118 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.0180 2.5562 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7589 1.2520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0418 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2588 1.2415 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 -0.0627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2408 -1.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9817 -2.6607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4816 -2.6712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2407 -1.3774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4997 -0.0731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2588 1.2206 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 0.0084 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0084 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1975 -1.9074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8336 -2.3581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2843 -0.7219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3517 0.2295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6252 3.5912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8661 2.2766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0408 -1.3481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3745 -3.6957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0744 -3.7145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4406 -1.3857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 M END