NCI:698972 BBtclserve11129920292D 0 0.00000 0.00000248016 Corina 01.500030 20.12.1994 28 32 0 0 0 0 0 0 0 0 1 V2000 6.8907 -0.1643 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2975 -1.0778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2920 -0.9733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4999 0.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6339 0.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8798 -1.7823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4731 -2.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4785 -2.8004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8907 -1.9914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6339 1.5049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4999 2.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3659 1.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3659 0.5049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4999 3.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3659 3.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2320 3.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2320 2.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0608 -3.5049 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.9126 0.0436 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7047 -0.9345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1205 1.0218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9344 0.2515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2653 -0.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2872 -0.2837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9781 0.6674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6473 1.4105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6254 1.2026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.8753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 19 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 13 1 0 0 0 0 4 5 2 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 17 1 0 0 0 0 12 13 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 M END