MMs02087575 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 43 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 -0.0217 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 -1.3178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2607 1.2550 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8607 2.2943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7606 1.2425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4997 -0.0628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7389 -1.3555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -0.0753 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7388 -1.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9779 -2.6733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7170 -3.9786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2170 -3.9911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9778 -2.6984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2387 -1.3932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4778 -2.7110 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 14.2386 -1.4183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2169 -4.0163 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 11.9561 -5.2964 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.5216 2.5603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2824 3.8530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0442 0.5913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5913 1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0442 -0.5913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0559 -1.9893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6304 -3.6322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0124 -3.2067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3632 -1.7377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0208 -2.4978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8757 0.3947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2182 1.1549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5622 2.4260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 1.6435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6084 0.9588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7780 -2.6633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1084 -5.0128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8474 -0.3590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7391 -1.3053 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 -0.0377 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0911 -1.0819 0.0000 H 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 2.4304 3.6171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 39 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 39 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 21 1 0 0 0 0 5 40 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 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 35 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 40 41 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END