NCI:621970 BBtclserve11129919392D 0 0.00000 0.00000212079 999-99-9 23 28 0 0 0 0 0 0 0 0 2 V2000 2.1045 -3.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1045 -1.1090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4135 -0.1580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0827 -3.3060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -2.4399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7226 -1.1090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4135 -0.1580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9135 -1.6968 0.0000 Ir 0 3 0 0 0 0 0 0 0 0 0 0 4.1857 0.0735 0.0000 S 0 3 0 0 0 0 0 0 0 0 0 0 5.1807 -0.0258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0136 -1.6499 0.0000 S 0 3 0 0 0 0 0 0 0 0 0 0 5.7642 0.7863 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7593 0.6870 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4245 1.4336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3402 1.0317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2409 0.0366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2638 -0.1764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3527 1.6977 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3735 1.9005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2638 2.8945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1752 3.3060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8482 2.5663 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 1 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 4 8 1 0 0 0 0 2 9 1 0 0 0 0 10 11 1 0 0 0 0 9 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 14 18 1 0 0 0 0 13 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 19 23 1 0 0 0 0 7 8 1 0 0 0 0 3 9 1 0 0 0 0 6 9 1 0 0 0 0 7 9 1 0 0 0 0 11 12 2 0 0 0 0 17 18 1 0 0 0 0 22 23 1 0 0 0 0 M CHG 3 9 1 10 1 12 1 M END $$$$