MMs02068858 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 0.5844 1.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3199 2.5783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8085 2.3936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3928 1.0121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4886 -0.1847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 -1.5662 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5341 -1.9054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6629 -3.3999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2814 -3.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2988 -2.8509 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4103 -5.4787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8714 -5.8180 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6456 -4.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6674 -0.9228 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0850 -1.4129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3694 -2.8857 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2183 -0.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9340 1.0426 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6360 -0.9204 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7693 0.0623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1870 -0.4278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3203 0.5548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7379 0.0647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2645 3.9598 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.7234 -0.9575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7752 1.5292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5318 3.3511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5837 0.8644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2105 -5.4563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2626 -6.6696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4651 -3.6566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6031 -5.2566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4399 0.2555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8635 -2.0986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8377 0.8187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3524 1.1111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6039 -1.4766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1186 -1.1842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3886 1.3112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9034 1.6037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6446 0.8508 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 M END