MMs01450397 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 55 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 0.7420 -1.3037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0161 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7259 -3.9017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2259 -3.9110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9839 -2.6166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2419 -1.3129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 1.2851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0278 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2579 1.2666 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8579 0.2273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 2.5702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 2.5795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2740 3.8646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7579 1.2573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5159 2.5517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 -0.0557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7418 -1.3593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9838 -2.6537 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2418 -1.3686 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9837 -2.6722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2257 -3.9666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9676 -5.2703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4676 -5.2795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2256 -3.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4837 -2.6815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2417 -1.3871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2096 -6.5832 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0429 0.5936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5936 1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0429 -0.5936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 -2.5906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1195 -4.9372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8194 -4.9539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1839 -2.6240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0935 -1.0707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9160 3.6094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0234 3.7795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 2.5869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0086 1.3795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3095 3.2582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8804 4.9001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2385 4.4710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7988 1.1274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1300 0.3478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8482 -0.3331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0257 -3.9592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3612 -6.3058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4256 -3.9926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2772 -1.9935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8481 -0.3516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2062 -0.7807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 M END