MMs03082490 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 58 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 -0.7388 -1.3054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2388 -1.3183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9776 -2.6237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4776 -2.6365 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6776 -2.6365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2387 -1.3440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4998 -0.0386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7386 -1.3568 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4997 -0.0643 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.0997 -1.1035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7609 1.2412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5220 2.5337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0219 2.5209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7831 3.8391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9997 -0.0771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7608 1.2155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7385 -1.3825 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2385 -1.3954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9996 -0.1028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4995 -0.1157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2383 -1.4211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4772 -2.7136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9773 -2.7008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7383 -1.4339 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -16.4771 -2.7393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.4994 -0.1414 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.2164 -3.9419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4553 -5.2345 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.6942 -6.5271 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0443 -0.5911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5911 1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0443 0.5911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3923 -1.7062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9371 -2.4889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0405 -0.1348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3699 -0.9175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8465 -3.0244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1759 -3.8072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3297 -2.4012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8351 0.4777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8483 2.0204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1220 3.5730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0322 3.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2219 2.5106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0116 1.3209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7388 3.2481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1921 4.8835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8275 4.4302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1296 -2.4166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4085 0.9415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1084 0.9184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0683 -3.7580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3684 -3.7348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7479 -5.9956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1628 -4.4734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1184 -5.0645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7376 -7.1956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 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 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 28 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 55 58 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END