MMs01341379 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 1.5000 -0.0084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2427 -1.3116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4855 -2.6064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7427 -1.3199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7427 -1.3366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9854 -2.6315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4854 -2.6231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2426 -1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9854 -2.6482 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4854 -2.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2426 -1.3617 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2281 -3.9598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7281 -3.9681 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4708 -5.2713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7136 -6.5662 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9708 -5.2797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7280 -3.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2280 -3.9932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9708 -5.2964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2135 -6.5913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7135 -6.5829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9563 -7.8777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9852 -2.6984 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0067 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0067 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9057 1.0175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6057 1.0024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5796 -3.6740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8797 -3.6590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0408 -0.1621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3725 -0.9409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3796 -3.6841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0982 -4.3639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4299 -5.1427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1338 -2.9423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1707 -5.3031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8077 -7.6338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5505 -8.9203 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 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 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 1 0 0 0 0 25 42 1 0 0 0 0 M END