MMs01721409 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 34 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 -1.5000 -0.0004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2503 1.2985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5006 2.5977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0006 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7497 1.2992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 3.8973 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.7503 1.2981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7497 -1.3000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 -0.0015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7497 -1.3007 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.9994 -2.5996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7490 -3.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2490 -3.8992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9994 -2.6003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2497 -1.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4994 -2.6007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2497 -1.3018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2490 -3.8999 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6003 -1.0391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0997 -1.0398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1009 3.6368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9497 1.2995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3506 2.3372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7919 1.1803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1277 0.4086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7994 -2.5993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1488 -4.9379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8488 -4.9386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8499 -0.2620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4490 -3.9002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6488 -4.9390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 M CHG 1 12 1 M END