NCI:695590 BBtclserve11129920282D 0 0.00000 0.00000246894 999-99-9 59 63 0 0 0 0 0 0 0 0 2 V2000 9.0279 3.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8939 2.8313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0279 4.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8939 4.8313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7599 4.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7599 3.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8939 5.8313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7599 6.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6259 5.8313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6259 4.8313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4890 3.8313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0768 4.6403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7678 2.0712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0768 3.0222 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1805 2.0324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3884 1.0543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 0.3851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 0.6941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4863 1.6723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2294 2.3414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0465 2.5324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7897 1.8633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4369 1.3280 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6260 1.8313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7599 1.3313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4920 1.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0643 -0.4665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8923 -1.4516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9533 -1.7953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1862 -1.1538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3580 -0.1687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2971 0.1749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7678 5.5913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7896 5.7992 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.6259 2.8313 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3829 0.9497 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5352 1.9813 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3273 2.9594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 0.0250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8532 -0.5930 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 -1.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2470 -1.4975 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 12.0751 -2.4826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4798 -0.8560 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 12.4920 0.3313 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3580 1.8313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6358 1.1158 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 15.6200 1.2929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9904 1.8796 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 15.6595 -2.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5986 -1.7494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2548 -3.7196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0828 -4.7047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8500 -5.3462 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.4876 -3.0782 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.6781 -6.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7891 -5.0025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7891 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 2 6 2 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 5 10 2 0 0 0 0 3 12 1 0 0 0 0 1 14 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 15 20 2 0 0 0 0 15 21 1 0 0 0 0 13 22 1 0 0 0 0 13 23 2 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 27 32 1 0 0 0 0 12 33 1 0 0 0 0 33 34 1 0 0 0 0 6 35 1 0 0 0 0 16 36 1 0 0 0 0 19 37 1 0 0 0 0 37 38 1 0 0 0 0 18 39 1 0 0 0 0 39 40 1 0 0 0 0 17 41 1 0 0 0 0 41 42 1 0 0 0 0 30 43 1 0 0 0 0 43 44 2 0 0 0 0 43 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 32 48 1 0 0 0 0 48 49 2 0 0 0 0 48 50 1 0 0 0 0 28 51 1 0 0 0 0 51 52 2 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 51 56 1 0 0 0 0 55 57 1 0 0 0 0 55 58 1 0 0 0 0 5 6 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 13 14 1 0 0 0 0 19 20 1 0 0 0 0 21 22 2 0 0 0 0 31 32 2 0 0 0 0 24 35 1 0 0 0 0 22 36 1 0 0 0 0 31 46 1 0 0 0 0 53 56 1 0 0 0 0 M CHG 4 43 1 45 -1 48 1 50 -1 M END