MMs02788975 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 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 1.2171 0.8767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5849 0.2610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7356 -1.2314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5185 -2.1081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1507 -1.4924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9762 -3.5366 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4761 -3.5428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9455 -2.1181 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3528 -4.7599 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8452 -4.6092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4610 -3.2414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9534 -3.0907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8301 -4.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2144 -5.6757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7219 -5.8263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1062 -7.1941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5691 -1.7229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0615 -1.5722 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9108 -0.0798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2122 -3.0647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5539 -1.4216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1696 -0.0538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6621 0.0969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5388 -1.1202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9230 -2.4880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4306 -2.6387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0312 -0.9695 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0942 0.4926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0966 2.0706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5586 0.9623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -2.1938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7596 -2.2677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0240 -4.1873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9157 -6.6494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8076 -8.1678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8677 -0.7492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4683 0.9199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1546 1.1912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6244 -3.4617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9380 -3.7329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 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 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 17 36 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 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 27 41 1 0 0 0 0 M END