MMs01048697 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 51 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 1.4738 0.2790 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1633 -0.8802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5658 -0.7494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8813 -0.0287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2972 -0.5240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4341 0.4545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1551 1.9283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7393 2.4236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6024 1.4451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1145 1.6353 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3937 2.9508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1726 4.2327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1059 2.9843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3878 3.7632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4214 2.2636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8499 -0.0409 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.3453 1.3750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3546 -1.4567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2658 -0.5362 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5447 -2.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4027 0.4423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8185 -0.0531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2500 -1.4897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7496 -1.5232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2450 -0.1074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0515 0.8012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2232 1.1791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1791 -0.2232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2232 -1.1791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6563 -1.5322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2492 -1.7358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5203 -1.7031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0646 2.7111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5161 3.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2047 4.1435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9523 4.8814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5646 3.9980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0363 1.1271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6075 2.0817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3657 -2.2332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7679 -3.1891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7238 -1.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4738 1.2020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9896 1.4889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5231 -2.4445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4331 -2.5096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3942 0.2378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 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 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 M END