MMs03555962 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 56 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 1.3720 0.6063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5329 2.0977 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 2.8441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5262 4.3121 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0349 4.4731 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 3.1044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0471 2.7966 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0477 3.9141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5158 3.6063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5164 4.7238 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1183 -0.4461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9845 4.4160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9851 5.5334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4532 5.2256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9206 3.8003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9200 2.6828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4520 2.9907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4513 1.8732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9188 0.4479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9833 2.1810 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2026 2.2302 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2026 3.4302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3553 0.7380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4186 3.1085 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7872 2.4946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9399 1.0024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0032 3.3729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3718 2.7591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5878 3.6374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4351 5.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0665 5.7435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8505 4.8652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4851 1.0976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0976 -0.4851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4851 -1.0976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6591 -0.5588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5693 0.6867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0283 4.5472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4942 5.0280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6111 6.6737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2537 6.1196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0951 3.5541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2940 1.5426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1615 0.6158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4775 -0.4558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5491 0.8601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2965 4.3023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4939 1.5653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6827 3.1463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4079 5.8322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9443 6.9372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7556 5.3563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 21 2 0 0 0 0 11 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 33 53 1 0 0 0 0 M END