BG8CK2
-OEChem-04012112552D
39 41 0 0 0 0 0 0 0999 V2000
8.3453 0.5823 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.7694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.7694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.7694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
8.6543 1.5334 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.0363 -0.3688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2320 2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2320 2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9230 1.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5411 1.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4921 1.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2353 2.1785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7000 0.5312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3942 0.8913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1863 1.8695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6511 0.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2964 0.2733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2969 3.3860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6256 2.8983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8385 2.8983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1672 3.3860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3566 2.0705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6130 1.2814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1064 2.7849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2393 0.1163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 0.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 0.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6471 2.2843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7800 -0.3843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1048 -0.3164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.8860 0.0817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4879 0.8629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 5 2 0 0 0 0
1 6 2 0 0 0 0
1 18 1 0 0 0 0
1 24 1 0 0 0 0
2 21 1 0 0 0 0
3 22 1 0 0 0 0
4 23 1 0 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 25 1 0 0 0 0
7 26 1 0 0 0 0
8 10 1 0 0 0 0
8 27 1 0 0 0 0
8 28 1 0 0 0 0
9 11 1 0 0 0 0
9 29 1 0 0 0 0
9 30 1 0 0 0 0
10 11 2 0 0 0 0
10 12 1 0 0 0 0
11 13 1 0 0 0 0
12 14 2 0 0 0 0
12 15 1 0 0 0 0
13 16 2 0 0 0 0
13 17 1 0 0 0 0
14 19 1 0 0 0 0
14 31 1 0 0 0 0
15 20 2 0 0 0 0
15 32 1 0 0 0 0
16 22 1 0 0 0 0
16 33 1 0 0 0 0
17 21 2 0 0 0 0
17 34 1 0 0 0 0
18 19 2 0 0 0 0
18 20 1 0 0 0 0
19 35 1 0 0 0 0
20 36 1 0 0 0 0
21 23 1 0 0 0 0
22 23 2 0 0 0 0
24 37 1 0 0 0 0
24 38 1 0 0 0 0
24 39 1 0 0 0 0
M END
$$$$