MMs01297784 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.2927 0.7609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 2.2609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5726 3.0218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8780 2.2828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8906 0.7829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0439 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4886 0.8048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4760 2.3048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0658 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9454 -0.7827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9633 -1.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4331 -1.7240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1721 -0.4187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1591 0.6875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4585 2.1573 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.9283 1.8578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9887 2.4568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7580 3.6271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1806 4.1027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4801 5.5725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3569 6.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9343 6.0912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6348 4.6214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6564 8.0365 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6088 1.0341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0341 -0.6088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6088 -1.0341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2357 2.8521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5625 4.2218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9121 2.8916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6081 -1.1780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2061 -1.1561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7634 -1.4347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8480 -2.6190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0720 -2.8684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5335 -2.2028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1489 -1.1158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9675 0.4798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0791 3.3073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6182 5.9529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0358 6.8865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4967 4.2409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 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 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 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 43 1 0 0 0 0 25 44 1 0 0 0 0 M END