MMs00743664 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 1.2963 0.7548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6036 -1.4904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9054 -2.2356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2017 -1.4808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8943 0.7644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5035 -2.2259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7997 -1.4711 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1723 -2.0762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4896 -3.5422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1719 -0.9577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6642 -1.1090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5414 0.1078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9262 1.4758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8034 2.6926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2958 2.5413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9109 1.1733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0337 -0.0435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4033 1.0220 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 17.2805 2.2388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0184 -0.3461 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.4171 0.3385 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.9510 0.0212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8326 1.0208 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6038 1.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -0.6038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6038 -1.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5666 -2.0942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9099 -3.4356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2331 0.6231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8899 1.9644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7355 -3.1480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2782 -3.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1563 -2.2035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7323 1.5968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3113 3.7870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5259 -1.1379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1729 3.7581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6808 4.8525 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END