NCI:660852 BBtclserve11129920082D 0 0.00000 0.00000231358 999-99-9 23 23 0 0 0 0 0 0 0 0 2 V2000 7.5781 3.0171 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5836 3.1216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0836 3.9876 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1054 3.7797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0009 2.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9145 2.3785 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1349 2.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2689 2.7852 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1349 1.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0009 0.7852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2689 0.7852 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 3.2688 -0.2148 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0779 -0.8026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7688 -1.7536 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7688 -1.7536 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4598 -0.8026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2689 3.7852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4028 4.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1811 -2.5626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 -3.4762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.2852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 -3.5807 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.4028 1.2852 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 2 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 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 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 12 16 1 0 0 0 0 8 17 1 0 0 0 0 17 18 1 0 0 0 0 15 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 5 6 1 0 0 0 0 15 16 2 0 0 0 0 M CHG 4 11 -1 15 1 22 -1 23 1 M END