MMs00353436 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 -0.7465 -1.3011 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2465 -1.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 -2.6061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4930 -2.6102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2465 -1.3132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7465 -1.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6249 -2.5331 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0527 -2.0734 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0568 -0.5734 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.7462 0.5857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6314 -0.1060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2726 0.3050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6980 -0.1624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5829 1.0488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7045 2.2647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2767 1.8050 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.2639 -2.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6358 -2.3519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8470 -3.2369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6862 -4.7282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3142 -5.3346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1031 -4.4497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8973 -5.6132 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0408 -0.5972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5972 1.0408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0408 0.5972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3902 -3.6438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0902 -3.6510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1028 1.0255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4028 1.0328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5938 0.4967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1225 0.9889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8819 -0.7335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7829 1.0456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0784 3.4049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7001 -1.7554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9445 -2.7517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1856 -6.5277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0055 -4.9348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M END