MMs01967596 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 0.0806 -1.4978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0838 -2.4435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5443 -3.8431 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1964 -4.8504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9536 -3.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3398 -2.3130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7881 -1.9228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8503 -2.9819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 -4.4314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0157 -4.8216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2986 -2.5917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6848 -1.1422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3607 -3.6508 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8091 -3.2606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3447 -1.8594 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8427 -1.9358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2330 -3.3842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9761 -4.2029 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.6824 -3.7704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7416 -2.7082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3513 -1.2599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9019 -0.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5332 -2.0573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1983 0.0645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0645 1.1983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1983 -0.0645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0971 -0.7632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3138 -5.2787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7068 -5.9812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0518 -4.8104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1768 -4.8587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6664 -4.4573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4313 -3.6902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8284 -2.1996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5466 -1.1536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4542 -0.0643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9179 -0.1868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4075 0.2146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2243 -0.8977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6928 -1.7483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8422 -3.2168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 M END