NCI:610054 BBtclserve11129919352D 0 0.00000 0.00000207350 999-99-9 37 44 0 0 0 0 0 0 0 0 3 V2000 3.5052 0.8147 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 4.4563 1.1237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0441 0.3147 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 3.5052 -0.1853 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9175 -0.9943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5052 -1.8033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4563 -1.4943 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.1995 -2.1634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9915 -3.1416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0405 -3.4506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2973 -2.7815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4563 -0.4943 0.0000 Mn 0 2 0 0 0 0 0 0 0 0 0 0 6.0743 -0.4943 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 5.2653 0.0935 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.9563 1.0446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9563 1.0446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6473 0.0935 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6691 -0.1144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.6287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 1.5798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2872 1.7877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7653 2.0748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0962 2.8179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4052 3.7690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3833 3.9769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0525 3.2338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7435 2.2827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 2.6100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3531 -2.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3476 -2.1498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9354 -2.9588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5287 -3.8724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5342 -3.9769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9464 -3.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7544 -1.2363 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7653 -1.4453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7653 -1.4453 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 1 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 6 11 1 0 0 0 0 3 12 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 12 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 16 21 1 0 0 0 0 2 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 22 27 2 0 0 0 0 23 28 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 29 34 2 0 0 0 0 30 35 1 0 0 0 0 13 36 1 0 0 0 0 12 37 1 0 0 0 0 10 11 2 0 0 0 0 7 12 1 0 0 0 0 4 12 1 0 0 0 0 13 14 1 0 0 0 0 16 17 2 0 0 0 0 20 21 2 0 0 0 0 26 27 1 0 0 0 0 33 34 1 0 0 0 0 29 36 1 0 0 0 0 36 37 2 0 0 0 0 M CHG 8 1 -1 3 1 4 1 7 1 12 2 13 -1 14 1 17 1 M CHG 1 37 1 M END