BFXB62
-OEChem-04022105532D
46 49 0 0 0 0 0 0 0999 V2000
4.5106 -3.7978 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.3255 0.0138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.9423 -4.7691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.6782 -0.5214 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.2959 -3.0735 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3984 2.8670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.0894 3.8180 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
5.7804 4.7691 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0
5.0091 -1.2646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3181 -2.2156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0150 -1.2672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2962 -2.4235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3692 0.4296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9654 -1.6804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7086 -2.2128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5124 -2.7978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6564 -0.7293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0383 1.1728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6028 -3.4190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3334 -0.4877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9875 -1.8812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6994 -2.4446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3170 -2.8694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6200 -3.6434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7293 2.1238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3191 -0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.6811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.6086 -4.0234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.5875 -4.2275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9875 0.9182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8218 0.1386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4200 0.6842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5858 1.4638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1826 -3.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5313 0.0999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3970 -1.4157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5152 -3.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8093 -4.2338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3476 2.6124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1819 1.8328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9056 -0.2340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3942 -1.8128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.7090 -2.6112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.4610 -4.8344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.1945 -4.3541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.7141 -3.6206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 16 2 0 0 0 0
2 17 2 0 0 0 0
3 28 2 0 0 0 0
4 9 1 0 0 0 0
4 13 1 0 0 0 0
4 17 1 0 0 0 0
5 23 1 0 0 0 0
5 28 1 0 0 0 0
5 43 1 0 0 0 0
6 7 2 0 0 0 0
6 25 1 0 0 0 0
7 8 2 0 0 0 0
9 10 2 0 0 0 0
9 11 1 0 0 0 0
10 12 1 0 0 0 0
10 16 1 0 0 0 0
11 15 1 0 0 0 0
11 20 2 0 0 0 0
12 14 2 0 0 0 0
12 19 1 0 0 0 0
13 18 1 0 0 0 0
13 30 1 0 0 0 0
13 31 1 0 0 0 0
14 17 1 0 0 0 0
14 21 1 0 0 0 0
15 16 1 0 0 0 0
15 22 2 0 0 0 0
18 25 1 0 0 0 0
18 32 1 0 0 0 0
18 33 1 0 0 0 0
19 24 2 0 0 0 0
19 34 1 0 0 0 0
20 26 1 0 0 0 0
20 35 1 0 0 0 0
21 23 2 0 0 0 0
21 36 1 0 0 0 0
22 27 1 0 0 0 0
22 37 1 0 0 0 0
23 24 1 0 0 0 0
24 38 1 0 0 0 0
25 39 1 0 0 0 0
25 40 1 0 0 0 0
26 27 2 0 0 0 0
26 41 1 0 0 0 0
27 42 1 0 0 0 0
28 29 1 0 0 0 0
29 44 1 0 0 0 0
29 45 1 0 0 0 0
29 46 1 0 0 0 0
M CHG 2 7 1 8 -1
M END
$$$$