MMs03475651 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 1.4201 -0.4832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5485 0.5051 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9686 0.0219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2602 -1.4495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6802 -1.9327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8087 -0.9444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5171 0.5269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0970 1.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2287 -1.4276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5203 -2.8990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3572 -0.4394 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7772 -0.9225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0688 -2.3939 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.9057 0.0657 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3258 -0.4175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4542 0.5707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8743 0.0876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1659 -1.3838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0374 -2.3720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6173 -1.8889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4889 -2.8771 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 17.5859 -1.8670 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 14.1626 2.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7426 2.5253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3865 1.1360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 0.3865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3865 -1.1360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8421 -1.5348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3554 -1.2349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3574 -2.2401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9135 -3.1098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4198 1.3175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8638 2.1872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1239 0.7377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6724 1.2428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7770 0.8781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2707 -3.5492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2911 3.0303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0578 4.2074 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 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 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 24 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 39 40 1 0 0 0 0 M END