MMs01341941 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 0.7579 1.2944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2579 1.2852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0159 2.5796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2738 3.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0318 5.1777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5318 5.1685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2738 3.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5158 2.5704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2579 1.2668 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7487 1.1009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0515 -0.3682 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7479 -1.1102 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6394 -0.0997 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7592 2.2094 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.2244 1.8886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2350 2.9971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7802 4.4265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7002 2.6763 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7107 3.7848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1760 3.4640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1865 4.5725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7318 6.0019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2665 6.3228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2560 5.2142 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.7423 7.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7528 8.2190 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 14.6337 8.1210 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 16.8508 6.1000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 14.6308 2.0346 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0355 0.6064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6064 -1.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0355 -0.6064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3671 1.7117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9736 2.4749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0739 3.8906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4382 6.2206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1381 6.2040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4738 3.8575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7681 0.7787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2382 1.2465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0641 1.5328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3588 4.3158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9027 7.4663 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 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 30 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 M END