MMs01988773 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 -0.7563 1.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0127 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4873 2.6054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2436 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7436 1.3173 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7563 -1.2807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7563 -1.2661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2562 -1.2588 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1438 -2.4680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6873 -3.8968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5681 -1.9975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7859 -2.8733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1533 -2.2565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3711 -3.1322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7384 -2.5154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8879 -1.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6701 -0.1472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3028 -0.7639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2552 -0.4061 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.5608 -0.4975 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.1320 -0.0410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6615 1.3833 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 3.9080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5949 -1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9563 1.2895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6177 3.6343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -1.0290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3385 2.3595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7858 1.2100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1255 0.4452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6306 -1.6820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9704 -2.4468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6663 -4.0673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2515 -4.3263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7127 -3.2160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7897 1.0469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3285 -0.0634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6259 4.9443 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 27 42 1 0 0 0 0 M END