MMs01453744 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 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 1.3005 0.7475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8986 0.7425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4966 0.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4995 2.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0947 0.7324 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5462 -1.5121 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0128 -1.8268 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7653 -0.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7638 0.5874 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0785 2.0540 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2574 -0.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8702 0.9938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3622 1.1477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2416 -0.0675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6288 -1.4366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1367 -1.5906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5082 -2.6519 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0404 -0.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5309 1.6682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0736 1.6653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -0.9228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3676 -0.9258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 1.6632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6717 1.6602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1938 -1.2100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0211 -0.9328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5638 -0.9358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2205 2.4226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1883 2.8587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1667 1.9660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8524 2.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4352 0.0556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6465 -2.6859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 40 1 0 0 0 0 M END