NCI:621806 BBtclserve11129919392D 0 0.00000 0.00000212011 999-99-9 40 45 0 0 0 0 0 0 0 0 2 V2000 7.3201 2.8929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4541 2.3929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4541 1.3929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3201 0.8929 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.1862 1.3929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1862 2.3929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0522 2.8929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9182 2.3929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9182 1.3929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0522 0.8929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0522 -0.1071 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 7.3201 -0.1071 0.0000 Ir 0 1 0 0 0 0 0 0 0 0 0 0 5.1498 0.0983 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7338 1.0077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7382 1.1020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1587 0.2869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5749 -0.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5705 -0.7169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9956 -1.4377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4116 -2.3468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4072 -2.4411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9866 -1.6261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4299 -1.1011 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.6241 -1.6931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7338 -2.6871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6493 -3.0890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4553 -2.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3455 -1.5030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1515 -0.9110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0671 -1.3130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1769 -2.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3709 -2.8989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6471 0.6325 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 6.8955 -0.6575 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 10.8731 -0.7209 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 9.4807 -3.8929 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 10.7842 0.8929 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 9.0522 3.8929 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.8234 -3.3505 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3435 0.0000 Br 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 6 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 10 11 1 0 0 0 0 4 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 13 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 18 22 1 0 0 0 0 12 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 23 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 27 32 1 0 0 0 0 30 35 1 0 0 0 0 32 36 1 0 0 0 0 9 37 1 0 0 0 0 7 38 1 0 0 0 0 21 39 1 0 0 0 0 19 40 1 0 0 0 0 5 6 1 0 0 0 0 9 10 2 0 0 0 0 17 18 1 0 0 0 0 21 22 2 0 0 0 0 27 28 1 0 0 0 0 31 32 2 0 0 0 0 29 33 1 0 0 0 0 22 34 1 0 0 0 0 M CHG 7 4 1 11 1 12 3 13 1 23 1 33 1 34 1 M END