MMs03340380 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 0.9061 -1.1954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3944 -1.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4204 -2.1026 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1948 -3.2812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7781 -1.4649 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1605 -2.0471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3475 -3.5354 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3559 -1.1411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7383 -1.7233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9337 -0.8172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9034 0.6825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3203 1.1748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2263 -0.0206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3694 -1.2518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7260 0.0097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4496 1.3237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9493 1.3541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7254 0.0705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0019 -1.2435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5022 -1.2739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2251 0.1009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0013 -1.1827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1690 0.3472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3644 1.2533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7866 0.9295 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5911 0.0234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1179 0.3055 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9563 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7249 0.9563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9563 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4403 -2.3013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3911 -4.2603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8879 -2.9139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9185 1.3680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6679 2.3233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8287 2.3506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5281 2.4052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6228 -2.2703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9234 -2.3250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9487 1.4148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.1484 1.4391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 41 42 1 0 0 0 0 M END