NCI:691251 BBtclserve11129920252D 0 0.00000 0.00000245059 999-99-9 40 43 0 0 0 0 0 0 0 0 2 V2000 2.0000 -5.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -4.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -5.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.6331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.6331 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.6331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.6331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -4.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -5.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -5.6331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -6.6331 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.6331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.1331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -1.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -2.1331 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.6331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.3669 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6499 1.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1111 0.0579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0132 0.0579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7432 2.9555 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2432 2.0895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2651 2.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1605 3.2919 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0741 3.6986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5219 1.6283 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.5709 1.9373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7298 0.6501 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7.4744 1.1759 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 8.2820 4.6768 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2330 4.9858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4409 5.9640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6978 6.6331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7467 6.3241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5388 5.3459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 1 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 5 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 9 14 1 0 0 0 0 10 15 1 0 0 0 0 11 16 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 3 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 21 25 1 0 0 0 0 23 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 26 30 1 0 0 0 0 28 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 30 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 35 40 1 0 0 0 0 5 6 1 0 0 0 0 9 10 2 0 0 0 0 13 14 2 0 0 0 0 18 19 1 0 0 0 0 26 27 1 0 0 0 0 29 30 2 0 0 0 0 39 40 1 0 0 0 0 M CHG 4 21 1 31 1 33 -1 34 -1 M END