NCI:326059 BBtclserve11129919042D 0 0.00000 0.00000174439 82641-26-7 39 46 0 0 0 0 0 0 0 0 2 V2000 7.8173 2.9392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2295 2.1302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5385 1.1791 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.2295 2.1302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7295 0.5913 0.0000 Mn 0 0 0 0 0 0 0 0 0 0 0 0 8.3475 0.5913 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 5.9205 1.1791 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.5603 2.8733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7295 -0.4087 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.6805 0.9003 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.7784 0.9003 0.0000 S 0 3 0 0 0 0 0 0 0 0 0 0 7.0385 -0.3597 0.0000 S 0 3 0 0 0 0 0 0 0 0 0 0 8.0385 -0.3597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9423 0.9712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5822 2.6654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6805 -0.7177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7784 -0.7177 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 8.2683 0.0913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0873 1.8139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1906 0.0913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7566 -1.0556 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2732 1.7143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8215 -1.7077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2628 0.1959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0818 1.9184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1906 0.0913 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6952 -0.7106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4412 -2.0046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6696 1.1094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7568 0.9923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7568 -0.8097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5502 -1.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9865 -2.8429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7818 1.2148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7818 -1.0322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6778 -2.2211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9818 -2.9392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4087 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 2 0 0 0 0 4 8 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 6 13 1 0 0 0 0 7 14 1 0 0 0 0 8 15 2 0 0 0 0 9 16 2 0 0 0 0 9 17 1 0 0 0 0 10 18 2 0 0 0 0 10 19 1 0 0 0 0 11 20 2 0 0 0 0 13 21 1 0 0 0 0 14 22 2 0 0 0 0 16 23 1 0 0 0 0 18 24 1 0 0 0 0 19 25 2 0 0 0 0 20 26 1 0 0 0 0 21 27 1 0 0 0 0 21 28 1 0 0 0 0 24 29 2 0 0 0 0 26 30 1 0 0 0 0 26 31 1 0 0 0 0 27 32 1 0 0 0 0 28 33 1 0 0 0 0 30 34 1 0 0 0 0 31 35 1 0 0 0 0 32 36 1 0 0 0 0 33 37 1 0 0 0 0 34 38 1 0 0 0 0 35 39 1 0 0 0 0 5 7 1 0 0 0 0 12 13 2 0 0 0 0 16 18 1 0 0 0 0 17 20 1 0 0 0 0 15 22 1 0 0 0 0 25 29 1 0 0 0 0 36 37 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 8 3 1 6 -1 7 1 9 1 10 1 11 1 12 1 17 -1 M END