MMs01212382 MOE2007 2D CORINA 3.40 0006 02.08.2006 60 62 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 1.3025 -0.7440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3095 -2.2439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 -2.9879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9075 -2.2319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9006 -0.7319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5911 1.5120 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4320 1.2015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8005 2.3993 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3304 3.8238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2064 5.0414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8304 3.8168 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6304 3.8168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3735 2.3881 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9431 5.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2292 1.9424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3393 2.9513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8780 3.5033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3068 3.0464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6254 1.5806 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5154 0.5717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0867 1.0286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0542 1.1237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3728 -0.3421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1642 2.1326 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.5929 1.6757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9116 0.2099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7030 2.6845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5952 1.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 0.5952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5952 -1.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -2.8488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6175 -4.1879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9495 -2.8271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 -0.1271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9106 5.7361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2332 5.9938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0245 4.3164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6708 0.8803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1783 1.2080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3902 3.6857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8977 4.0134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4365 4.5654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9290 4.2377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4683 4.2354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5058 3.0938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4644 -0.1627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9569 -0.4904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9252 -0.1604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8876 0.9812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9093 3.3052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7520 1.3651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7390 -0.0450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1665 -0.9627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0842 0.4648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5101 1.7965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5910 3.4916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8959 3.5726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7680 2.4944 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 60 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 60 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 60 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 M END