NCI:44584 BBtclserve11129917012D 0 0.00000 0.00000 38733 91495-43-1 23 25 0 0 0 0 0 0 0 0 2 V2000 4.4487 0.8886 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -0.1114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 1.3886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.6114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -0.6114 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4781 2.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 0.9819 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -1.6114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2658 -0.3024 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -1.6114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2213 3.0523 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5000 2.5910 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4612 0.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2658 -1.9204 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -2.1114 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8536 -1.1114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7167 -2.1114 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0134 4.0304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1723 2.7433 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.5748 -2.8715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5530 -3.0794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8620 -4.0304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 3 6 2 0 0 0 0 3 7 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 5 10 2 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 8 15 1 0 0 0 0 8 16 2 0 0 0 0 9 17 2 0 0 0 0 10 18 1 0 0 0 0 11 19 2 0 0 0 0 11 20 1 0 0 0 0 15 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 12 14 2 0 0 0 0 10 16 1 0 0 0 0 15 17 1 0 0 0 0 M CHG 2 11 1 20 -1 M END