MMs01022758 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 1.2927 -0.7609 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0218 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5588 0.5782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8907 -0.7826 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9299 -1.3826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8781 -2.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -3.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1583 -4.5434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 -5.2825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5603 -4.5216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5728 -3.0217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2801 -2.2608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0251 -2.9999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2085 1.4564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4887 -0.8044 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8065 1.4346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1118 2.1737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4045 1.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3919 -0.0871 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0867 -0.8262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6106 1.4782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4045 2.3700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8799 3.7926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3799 3.7801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8314 2.3496 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6087 1.0342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0342 0.6087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6087 -1.0342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2150 -2.4522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1924 -5.1521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8429 -6.4824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 -5.1129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4786 -2.0044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7724 2.0433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1219 3.3737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4487 2.0041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0766 -2.0261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2601 2.0087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1827 4.7693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0933 4.7449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 24 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 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 12 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 M END