MMs02942233 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 49 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 0.0004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2497 1.2996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4993 2.5985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0007 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7503 1.2988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4646 4.0245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7487 4.9065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9625 4.0252 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1037 4.3963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8913 4.4877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2035 5.9548 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5141 7.1139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0891 6.9588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4013 8.4260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6302 6.4180 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7447 5.4140 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7407 4.2996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7487 6.5285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8591 4.4100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5469 2.9429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6613 1.9389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0881 2.4021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4003 3.8692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2858 4.8732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8270 4.3324 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.0768 5.5061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9415 3.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3682 3.7915 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.6292 1.8612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7437 0.8572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2025 1.3981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9527 0.2244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5997 -1.0394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1003 -1.0387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4497 1.2999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9503 1.2985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7484 6.1065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 3.2993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0905 4.4455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 7.5917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4055 2.5724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4116 0.7652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5356 6.0469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3376 6.4957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2292 7.2989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 32 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 45 46 1 0 0 0 0 M END