MMs01936994 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 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 1.0838 -1.0370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5238 -0.6168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6076 -1.6538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0476 -1.2337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4037 0.2234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3199 1.2604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8799 0.8403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8437 0.6436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9275 -0.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3675 0.0267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8740 1.4386 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3733 1.3932 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7934 -0.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5537 -0.8913 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.2053 -0.5532 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3499 0.4163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0826 1.8923 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7618 -0.0902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0291 -1.5662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4410 -2.0727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5856 -1.1032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3183 0.3728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9064 0.8793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6391 2.3553 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.8296 0.8671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8671 0.8296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8296 -0.8671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3227 -2.8195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9146 -2.0633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6048 2.4261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0129 1.6698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1286 1.8092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6426 -1.5591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4192 -1.7340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1134 -2.3418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6549 -3.2535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7151 -1.5084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2339 1.1484 0.0000 H 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 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 19 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 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 M END