NCI:46724 BBtclserve11129917022D 0 0.00000 0.00000 40484 4950-04-3 23 23 0 0 0 0 0 0 0 0 2 V2000 4.9368 0.5158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9210 0.6928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2914 1.2796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.4251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2598 1.6337 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5665 -0.0710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6301 2.2204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3072 1.1025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.9251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.9251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2440 1.8108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9846 2.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.4251 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7320 -1.9251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.9251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5827 2.7517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3234 3.9251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5749 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5981 -2.4251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.4251 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.4641 -3.9251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.9251 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 2 5 1 0 0 0 0 2 6 2 0 0 0 0 3 7 1 0 0 0 0 3 8 2 0 0 0 0 4 9 2 0 0 0 0 4 10 1 0 0 0 0 5 11 1 0 0 0 0 7 12 1 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 10 15 2 0 0 0 0 11 16 1 0 0 0 0 12 17 1 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 14 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 15 20 1 0 0 0 0 M CHG 4 13 1 19 -1 21 1 23 -1 M END