MMs00712612 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 44 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 1.3047 0.7401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9027 0.7203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5007 0.7006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5121 2.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8168 2.9406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1101 2.1808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0987 0.6808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -0.0790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3806 -1.5790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6967 0.6611 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9900 -0.0988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9786 -1.5988 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2947 0.6413 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5880 -0.1186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5766 -1.6185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8699 -2.3784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1746 -1.6383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1860 -0.1383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8927 0.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9041 2.1215 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 19.4679 -2.3981 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5921 1.0438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0438 -0.5921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5921 -1.0438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5404 1.6652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 1.6535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8197 -0.9331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3623 -0.9449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1384 1.6454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6810 1.6337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4775 2.8084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8259 4.1406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1539 2.7729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7849 -1.2592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7058 1.8610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3038 1.8413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5328 -2.2106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8608 -3.5783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2298 0.4538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 38 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 39 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 M END