MMs01821269 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 64 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 0.3241 -1.4646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7822 -2.4775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4581 -3.9421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4524 -5.0652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6916 -6.3579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4307 -7.6631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6699 -8.9559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9307 -7.6757 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -8.7199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6915 -6.3829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9524 -5.0777 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1914 -6.3955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9523 -5.1027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4522 -5.1153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1913 -6.4205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4305 -7.7133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9306 -7.7007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1697 -8.9935 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9089 -10.2987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1481 -11.5914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2130 -3.8225 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.9203 -3.0617 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5058 -4.5834 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9739 -2.5298 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.4738 -2.5423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2129 -3.8476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7129 -3.8601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4737 -2.5674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7346 -1.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2346 -1.2496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4954 0.0306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7563 1.3358 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -14.9737 -2.5799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -6.0338 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9173 -4.5407 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8960 -7.0281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1717 0.2593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2593 1.1717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1717 -0.2593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4329 -1.0058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9685 -2.4769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4266 -1.4652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8910 -2.9363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3610 -4.0585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3913 -6.4306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0218 -8.7575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8345 -9.5351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8217 -11.0777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1822 -12.2001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5394 -12.6256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1139 -10.9828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3826 -1.4856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6043 -4.8818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3042 -4.9043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6433 -0.2054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5650 -3.6241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1005 -7.9266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7945 -7.8236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6915 -6.1297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9954 0.0181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 41 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 3 43 1 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 36 2 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 30 2 0 0 0 0 29 34 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 61 2 0 0 0 0 34 57 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 37 58 1 0 0 0 0 37 59 1 0 0 0 0 37 60 1 0 0 0 0 M CHG 1 33 -1 M END