MMs01422342 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 50 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 1.2943 0.7581 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 2.2580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0162 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3399 1.3198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8561 -1.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9017 -0.7258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9110 -2.2257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2147 -2.9676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5091 -2.2096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4997 -0.7096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7848 1.5484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0978 -0.6934 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 0.0646 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3921 -1.1354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3828 1.5646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6771 2.3226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9808 1.5807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2752 2.3388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2658 3.8388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9622 4.5807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6678 3.8226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6958 -0.6773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 0.0808 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7051 -2.1773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0088 -2.9192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8127 -2.9515 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6064 1.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0355 -0.6064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6064 -1.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 2.2655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2776 3.4580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 2.2506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8755 -2.8322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2222 -4.1676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1886 1.2323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1052 -1.8934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2023 1.3489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9654 2.6896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9845 0.9807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3181 1.7453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3013 4.4452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9547 5.7807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6249 4.4161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4153 -3.9621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0517 -3.5127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6023 -1.8762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 25 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END