NCI:633802 BBtclserve11129919502D 0 0.00000 0.00000218314 999-99-9 43 48 0 0 0 0 0 0 0 0 2 V2000 6.0296 0.0000 0.0000 Cd 0 2 0 0 0 0 0 0 0 0 0 0 7.7616 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8956 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7616 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8956 -3.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0296 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0296 -2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8956 -0.5000 0.0000 S 0 3 0 0 0 0 0 0 0 0 0 0 8.7127 -1.6910 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3005 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7127 -3.3090 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0296 -1.0000 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 6.8956 0.5000 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 3.5561 -0.9392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3233 -0.2977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 -0.5955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4451 0.3895 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2123 1.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1514 0.6873 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2624 -0.6414 0.0000 S 0 3 0 0 0 0 0 0 0 0 0 0 3.5195 -1.9385 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5577 -2.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3825 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2975 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1635 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2975 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1635 3.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0296 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0296 2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1635 0.5000 0.0000 S 0 3 0 0 0 0 0 0 0 0 0 0 3.3465 1.6910 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7587 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3465 3.3090 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7616 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8956 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6276 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6276 2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7616 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8956 2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0296 1.0000 0.0000 S 0 3 0 0 0 0 0 0 0 0 0 0 7.9695 0.0219 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9641 -0.0827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3708 0.8309 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 3 7 1 0 0 0 0 1 8 1 0 0 0 0 2 9 1 0 0 0 0 9 10 2 0 0 0 0 4 11 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 15 19 1 0 0 0 0 1 20 1 0 0 0 0 14 21 1 0 0 0 0 21 22 2 0 0 0 0 16 23 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 25 29 1 0 0 0 0 1 30 1 0 0 0 0 24 31 1 0 0 0 0 31 32 2 0 0 0 0 26 33 1 0 0 0 0 34 35 1 0 0 0 0 34 36 2 0 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 35 39 1 0 0 0 0 1 40 1 0 0 0 0 34 41 1 0 0 0 0 41 42 2 0 0 0 0 36 43 1 0 0 0 0 6 7 1 0 0 0 0 3 8 2 0 0 0 0 10 11 1 0 0 0 0 18 19 1 0 0 0 0 15 20 2 0 0 0 0 22 23 1 0 0 0 0 28 29 1 0 0 0 0 25 30 2 0 0 0 0 32 33 1 0 0 0 0 38 39 1 0 0 0 0 35 40 2 0 0 0 0 42 43 1 0 0 0 0 M CHG 7 1 2 8 1 12 -1 13 -1 20 1 30 1 40 1 M END