NCI:31345 BBtclserve11129916532D 0 0.00000 0.00000 27666 86795-25-7 37 40 0 0 0 0 0 0 0 0 1 V2000 8.8712 0.5864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8712 1.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7372 2.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0052 2.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7372 3.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6033 1.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1392 1.5864 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0052 3.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8712 3.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6033 3.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6033 0.5864 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4693 2.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1392 0.5864 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1392 3.5864 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.4693 3.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 0.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 4.0864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6392 2.7204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6392 4.4524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3353 3.5864 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 0.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 -0.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2013 4.0864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8353 4.4524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8353 2.7204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 0.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 -1.4136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 -0.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -1.4136 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -1.9136 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1751 -0.5476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -2.2796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -2.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 -3.5014 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.5014 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -4.4524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -4.4524 0.0000 C 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 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 2 0 0 0 0 5 9 2 0 0 0 0 5 10 1 0 0 0 0 6 11 1 0 0 0 0 6 12 2 0 0 0 0 7 13 2 0 0 0 0 8 14 1 0 0 0 0 10 15 2 0 0 0 0 13 16 1 0 0 0 0 14 17 2 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 20 1 0 0 0 0 16 21 2 0 0 0 0 16 22 1 0 0 0 0 20 23 2 0 0 0 0 20 24 2 0 0 0 0 20 25 1 0 0 0 0 21 26 1 0 0 0 0 22 27 2 0 0 0 0 26 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 29 32 2 0 0 0 0 30 33 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 34 36 1 0 0 0 0 35 37 1 0 0 0 0 8 9 1 0 0 0 0 12 15 1 0 0 0 0 27 28 1 0 0 0 0 36 37 2 0 0 0 0 M END