MMs01556472 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 1.3739 0.6019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5397 2.0927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9136 2.6946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1218 1.8057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9561 0.3148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5822 -0.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1643 -0.5741 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5383 0.0278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8589 1.4931 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3516 1.6410 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9535 0.2670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8328 -0.7300 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.4188 -0.0536 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.4292 1.0551 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.0292 2.0943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9742 2.4844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8945 0.7344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3495 -0.6949 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9049 1.8431 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.3702 1.5225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8252 0.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2905 -0.2275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3009 0.8812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8459 2.3105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3806 2.6312 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.7662 0.5605 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.4815 1.0992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0992 -0.4815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4815 -1.0992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5731 2.8038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0462 3.8872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2210 2.2872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4496 -1.4797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0318 -1.7667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1177 2.8484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6102 3.6279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8308 2.1204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5409 2.9866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0169 -0.7938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6545 -1.3710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6542 3.1975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 M END