MMs02054379 MOE2007 2D CORINA 3.40 0006 02.08.2006 35 36 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 -0.6992 -1.3271 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1981 -1.3851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9978 -0.1161 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8972 -2.7122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2346 -4.0579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3096 -5.1039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6367 -4.4048 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3818 -2.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4279 -1.8515 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8820 -2.2199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2900 -3.6634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9280 -1.1449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3821 -1.5132 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.0137 -2.9673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7505 -0.0592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8362 -1.8816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8822 -0.8066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3363 -1.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7443 -2.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6982 -3.6935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2442 -3.3251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0617 -0.5593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5593 1.0617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0617 0.5593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -4.2618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1381 -6.2916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1015 -0.6968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9357 -0.4701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4203 -0.0505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5558 0.3482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1731 -0.3149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9075 -2.9131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0246 -4.8482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4073 -4.1851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 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 9 2 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 28 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 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 M END