NCI:315234 BBtclserve11129919012D 0 0.00000 0.00000172045 75224-85-0 22 24 0 0 0 0 0 0 0 0 1 V2000 8.1779 -0.0823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1998 0.1256 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4869 -1.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8907 1.0766 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4380 -1.3424 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8991 -1.8424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9126 1.2845 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.4380 -2.3424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3890 -1.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8991 -1.8424 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.4869 -2.6514 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1205 2.2627 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7047 0.3064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9344 1.4925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3891 -2.6514 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.9768 -1.8424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2653 0.7493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6254 2.4435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2872 0.9572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6473 2.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9781 1.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.1162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 7 12 2 0 0 0 0 7 13 2 0 0 0 0 7 14 1 0 0 0 0 8 15 1 0 0 0 0 9 16 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 17 19 1 0 0 0 0 18 20 2 0 0 0 0 19 21 2 0 0 0 0 21 22 1 0 0 0 0 8 11 2 0 0 0 0 15 16 1 0 0 0 0 20 21 1 0 0 0 0 M END