NCI:135829 BBtclserve11129917432D 0 0.00000 0.00000102831 28558-54-5 24 26 0 0 0 0 0 0 0 0 2 V2000 4.9921 -1.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9703 -0.9976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6831 -2.1566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2793 -0.0465 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6394 -1.7407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.4656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2709 -2.9656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2574 0.1614 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -3.4656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6831 -3.7746 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5664 1.1124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.9656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.4656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5446 1.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.4656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8536 2.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2137 0.5772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1845 3.0145 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 9.8317 2.4793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1919 0.7851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4935 3.9656 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2063 2.8066 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 10.5009 1.7362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 2 0 0 0 0 3 6 1 0 0 0 0 3 7 2 0 0 0 0 4 8 1 0 0 0 0 6 9 2 0 0 0 0 6 10 1 0 0 0 0 7 11 1 0 0 0 0 8 12 2 0 0 0 0 9 13 1 0 0 0 0 10 14 2 0 0 0 0 12 15 1 0 0 0 0 13 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 18 21 2 0 0 0 0 19 22 2 0 0 0 0 19 23 1 0 0 0 0 20 24 2 0 0 0 0 9 11 1 0 0 0 0 14 16 1 0 0 0 0 21 24 1 0 0 0 0 M CHG 2 19 1 23 -1 M END