MMs01394529 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 -0.7441 -1.3024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0117 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5117 -2.5913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2558 -1.2889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7244 -1.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8879 -3.0852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5204 -3.7015 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2762 -4.8764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8346 -0.5855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2633 -1.0426 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9527 0.1165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3735 -0.0339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8021 -0.4910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0550 1.4319 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1652 2.4406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0017 3.9317 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3693 4.5480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3780 3.4378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6338 2.1354 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5817 -2.5084 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0104 -2.9655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1206 -1.9568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3289 -4.4313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7019 -5.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5518 -6.5277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0860 -6.8462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3302 -5.5505 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6047 1.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9441 -1.3078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5836 -3.6400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0953 1.0487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9298 -3.6806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8857 0.1491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3932 0.4766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9121 1.7976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6135 5.7228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5708 3.5686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6936 -3.3153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7384 -4.4306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4472 -7.3266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6029 -7.9446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 22 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 27 28 2 0 0 0 0 27 42 1 0 0 0 0 28 29 1 0 0 0 0 28 43 1 0 0 0 0 M END