MMs03447682 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 -0.7505 -1.2988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0009 -2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7514 -3.8968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2514 -3.8963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0019 -5.1951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2523 -6.4944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7523 -6.4949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0019 -5.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4981 -5.1967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2477 -6.4960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0028 -7.7932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5028 -7.7926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2533 -9.0914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0037 -10.3901 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2523 -6.4933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7441 -6.3360 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5473 -7.2275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0554 -4.8686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3542 -4.1182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3536 -2.6182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0543 -1.8686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7556 -2.6191 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7561 -4.1191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6417 -5.1232 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6524 -1.8677 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -0.6004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6004 1.0390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 0.6004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6694 -0.5271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 -2.0698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 -2.8569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6019 -5.1949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1527 -7.5344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2082 -7.0956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8473 -7.5354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2871 -5.8964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4032 -8.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3936 -4.7178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0539 -0.6686 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 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 3 0 0 0 0 16 17 1 0 0 0 0 16 25 2 0 0 0 0 17 18 1 0 0 0 0 17 19 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 39 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 M END