MMs02245089 MOE2007 2D CORINA 3.40 0006 02.08.2006 25 25 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 -0.7418 1.3038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2417 1.3133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 0.0190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2582 -1.2848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7582 -1.2943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 0.0285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2417 1.3323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7416 1.3418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4834 2.6455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9834 2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7416 1.3608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7251 3.9588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4214 4.7005 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -11.0289 3.2170 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -10.4669 5.2625 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1352 2.3392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8351 2.3563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8647 -2.3202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1648 -2.3373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1115 1.7355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4426 2.5153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5407 0.1587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8718 0.9385 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 17 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 11 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 M END