NCI:645049 BBtclserve11129920012D 0 0.00000 0.00000224116 999-99-9 25 28 0 0 0 0 0 0 0 0 2 V2000 4.5691 0.8026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3781 0.2148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1871 0.8026 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8781 1.7536 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8781 1.7536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 0.4936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -0.4575 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -0.4575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.4936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 1.0814 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2903 2.5627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2958 2.4581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 3.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1148 4.1807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1093 4.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6971 3.4762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3781 -0.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5121 -1.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5121 -2.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3781 -2.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2441 -2.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2441 -1.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3781 -3.7852 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.2441 -4.2852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5121 -4.2852 0.0000 O 0 5 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 2 0 0 0 0 1 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 6 10 1 0 0 0 0 5 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 11 16 2 0 0 0 0 2 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 20 21 2 0 0 0 0 17 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 4 5 1 0 0 0 0 9 10 1 0 0 0 0 15 16 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 2 23 1 25 -1 M END