NCI:17454 BBtclserve11129916472D 0 0.00000 0.00000 16568 999-99-9 41 48 0 0 0 0 0 0 0 0 2 V2000 5.0000 2.0412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 2.9073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 2.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 2.9073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6728 1.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5878 2.8503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 3.7733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 2.0412 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5388 1.5413 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.6728 0.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2788 3.8013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5388 2.5413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.7733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4049 1.0413 0.0000 Zn 0 0 0 0 0 0 0 0 0 0 0 0 7.5389 -0.4587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4049 3.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5388 1.5413 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2709 1.5413 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4049 0.0413 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 9.4410 -1.0768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2709 2.5413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4410 2.1593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1369 1.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5389 -0.4587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2709 -0.4587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9089 -1.9605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6165 0.5413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2220 2.8503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6728 0.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1369 0.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8097 2.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0685 -1.5414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0630 -1.4369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9082 -1.9972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6165 0.5413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5310 3.8013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4408 -2.3628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3762 -2.8809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3755 -2.9176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8448 -3.7281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8434 -3.8013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 2 0 0 0 0 4 7 1 0 0 0 0 4 8 2 0 0 0 0 5 9 2 0 0 0 0 5 10 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 13 1 0 0 0 0 9 14 1 0 0 0 0 10 15 2 0 0 0 0 12 16 2 0 0 0 0 14 17 1 0 0 0 0 14 18 1 0 0 0 0 14 19 1 0 0 0 0 15 20 1 0 0 0 0 16 21 1 0 0 0 0 17 22 1 0 0 0 0 18 23 1 0 0 0 0 19 24 2 0 0 0 0 19 25 1 0 0 0 0 20 26 1 0 0 0 0 20 27 2 0 0 0 0 21 28 2 0 0 0 0 22 29 2 0 0 0 0 23 30 1 0 0 0 0 23 31 2 0 0 0 0 24 32 1 0 0 0 0 25 33 1 0 0 0 0 26 34 1 0 0 0 0 27 35 1 0 0 0 0 28 36 1 0 0 0 0 33 37 1 0 0 0 0 34 38 1 0 0 0 0 38 39 1 0 0 0 0 38 40 2 0 0 0 0 39 41 1 0 0 0 0 9 12 1 0 0 0 0 15 17 1 0 0 0 0 18 21 1 0 0 0 0 22 27 1 0 0 0 0 24 29 1 0 0 0 0 25 30 2 0 0 0 0 28 31 1 0 0 0 0 32 33 2 0 0 0 0 M CHG 2 9 1 19 1 M END