MMs02017807 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 38 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 -1.4991 0.0534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9115 1.4955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6674 2.3335 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 1.4092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3207 2.0095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4704 1.0461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5802 3.4869 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5375 4.5652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2408 5.8901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7182 5.6306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9280 4.1453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2529 3.4420 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.5244 4.2377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8493 3.5344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9026 2.0354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2275 1.3321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4991 2.1278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4457 3.6268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1208 4.3302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8240 1.4245 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -14.0955 2.2202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.8773 -0.0746 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6704 -0.9953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2385 -0.8918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6677 1.7392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7668 3.6454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5422 5.2356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1279 6.3389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5708 7.0438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7209 5.1290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2626 5.1839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8854 1.3988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2702 0.1328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4630 4.2634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0782 5.5294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END