MMs02888098 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 44 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 -1.5000 -0.0118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2601 1.2814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5203 2.5862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0204 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7398 1.3049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2397 1.3166 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2601 -1.2814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2397 1.3401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7396 1.3519 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 0.0588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7600 -1.2461 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2600 -1.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5202 -2.5627 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7724 -2.3529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1379 -1.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9694 -0.2416 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7601 1.2696 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7718 2.7696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7483 -0.2303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 1.2578 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0202 2.5510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4208 3.9260 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5434 4.9210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8365 4.1608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5131 2.6961 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6081 -1.0345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0918 -1.0557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1284 3.6207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5715 3.6419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8316 2.3605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6315 2.3746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8071 -3.0658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3805 -3.3874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5176 -2.8704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3097 -1.4734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8519 0.2139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4273 6.1153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9366 4.6403 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 40 1 0 0 0 0 27 28 1 0 0 0 0 27 41 1 0 0 0 0 M END