NCI:205077 BBtclserve11129918182D 0 0.00000 0.00000138676 78682-88-9 17 18 0 0 0 0 0 0 0 0 2 V2000 4.9483 0.7068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 0.2068 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8144 0.2068 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 1.7068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -0.7932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1393 2.2946 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7574 2.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2733 -1.3810 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8913 -1.3810 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4484 3.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4484 3.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 -2.3321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5823 -2.3321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8606 4.0546 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 -3.1411 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.4013 -4.0546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.0366 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 2 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 2 0 0 0 0 5 8 1 0 0 0 0 5 9 2 0 0 0 0 6 10 1 0 0 0 0 7 11 1 0 0 0 0 8 12 1 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 10 11 2 0 0 0 0 12 13 2 0 0 0 0 M CHG 2 15 1 17 -1 M END