NCI:289491 BBtclserve11129918452D 0 0.00000 0.00000163601 1403-36-7 47 55 0 0 0 0 0 0 0 0 1 V2000 3.9456 4.4859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8116 3.9859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8116 2.9859 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6776 4.4859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0685 2.3168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6776 2.4859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6776 5.4859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5437 3.9859 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2776 3.8859 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4752 1.4033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0739 2.2123 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4697 1.5078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5437 2.9859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2776 3.0859 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5437 5.9859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4097 4.4859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.7341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8819 0.4897 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.2341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4097 2.4859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.2659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8601 0.2818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3819 -0.3763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9646 -0.7127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6691 0.8696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0511 -1.1194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8782 -1.1194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5826 0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8432 -2.0976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6872 -0.5317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1883 -3.8131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2028 -3.5729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5756 -2.3964 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0008 -5.8658 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5857 -2.7859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0827 -4.5656 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6958 -1.4036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1927 -3.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9936 -5.9859 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2958 -5.1827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8053 -4.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1854 -3.3035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4224 -5.3870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4124 -5.2461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 6 14 1 0 0 0 0 7 15 1 0 0 0 0 8 16 1 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 11 19 1 0 0 0 0 13 20 2 0 0 0 0 17 21 2 0 0 0 0 18 22 1 0 0 0 0 18 23 1 0 0 0 0 19 24 2 0 0 0 0 21 25 1 0 0 0 0 22 26 2 0 0 0 0 22 27 1 0 0 0 0 23 28 2 0 0 0 0 24 29 1 0 0 0 0 26 30 1 0 0 0 0 27 31 2 0 0 0 0 28 32 1 0 0 0 0 30 33 2 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 37 1 0 0 0 0 35 38 2 0 0 0 0 35 39 1 0 0 0 0 36 40 1 0 0 0 0 36 41 1 0 0 0 0 37 42 1 0 0 0 0 39 43 1 0 0 0 0 39 44 1 0 0 0 0 41 45 2 0 0 0 0 44 46 1 0 0 0 0 46 47 1 0 0 0 0 10 12 1 0 0 0 0 8 13 1 0 0 0 0 9 14 1 0 0 0 0 17 19 1 0 0 0 0 26 28 1 0 0 0 0 25 29 2 0 0 0 0 31 33 1 0 0 0 0 41 44 1 0 0 0 0 42 44 1 0 0 0 0 M END