MMs00931553 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 42 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 1.4999 0.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4874 1.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5125 -1.4874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7607 -1.2676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0216 -2.5729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2607 -1.2551 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0215 -2.5478 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6215 -1.5086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2824 -3.8531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0432 -5.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3041 -6.4511 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0650 -7.7438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5215 -2.5353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2823 -3.8280 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2606 -1.2300 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7605 -1.2175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4996 0.0878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7388 1.3805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9996 0.1004 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6874 1.5225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4774 2.7124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8874 1.5075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9125 -1.4924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5225 -2.6874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7124 -1.4774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8520 -0.2109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3567 -3.0894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3696 -4.6321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9560 -4.3668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9689 -5.9094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0308 -8.3525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6736 -8.7780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0991 -7.1351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6519 -0.1958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5620 -2.4009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8915 -1.6184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6083 -0.9338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5909 1.1446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 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 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 M END