NCI:613259 BBtclserve11129919362D 0 0.00000 0.00000208259 999-99-9 43 45 0 0 0 0 0 0 0 0 2 V2000 2.4067 5.0420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 5.1465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 4.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 3.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 3.3194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.1284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 2.6149 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7633 1.7014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7688 1.5968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3511 0.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3511 0.8923 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6601 -0.0587 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8511 -0.6465 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.0421 -0.0587 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8191 -1.3459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7702 -1.6549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5133 -0.9858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3054 -0.0076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3543 0.3014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6112 -0.3677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9851 -2.1465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8511 -1.6465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7171 -2.1465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7171 -3.1465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8511 -3.6465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9851 -3.1465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0485 0.6615 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.7917 1.3306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7177 -0.0816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3794 1.4047 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.1191 -1.6465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8511 -4.6465 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.9851 -5.1465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7171 -5.1465 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.5832 -3.6465 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4492 -4.1465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0832 -2.7805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0832 -4.5125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4644 -1.2948 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 9.6723 -2.2729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2075 -0.6257 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.2530 -2.1465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2075 0.0000 0.0000 Na 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 4 5 2 0 0 0 0 1 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 10 14 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 12 20 1 0 0 0 0 13 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 21 26 1 0 0 0 0 18 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 21 31 1 0 0 0 0 25 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 24 35 1 0 0 0 0 35 36 2 0 0 0 0 35 37 2 0 0 0 0 35 38 1 0 0 0 0 17 39 1 0 0 0 0 39 40 2 0 0 0 0 39 41 1 0 0 0 0 31 42 1 0 0 0 0 5 6 1 0 0 0 0 13 14 2 0 0 0 0 19 20 2 0 0 0 0 15 20 1 0 0 0 0 21 22 2 0 0 0 0 25 26 2 0 0 0 0 M CHG 6 13 1 30 -1 32 1 34 -1 39 1 41 -1 M END