BT1EO4
-OEChem-04022108552D
41 42 0 0 0 0 0 0 0999 V2000
2.5369 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2690 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2690 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8890 3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6490 3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2690 1.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8890 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2690 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2690 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6490 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2690 1.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6720 1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -0.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6910 -2.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3110 -4.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1360 -1.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1360 -3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 10 1 0 0 0 0
1 34 1 0 0 0 0
2 11 1 0 0 0 0
2 15 1 0 0 0 0
3 15 2 0 0 0 0
4 5 1 0 0 0 0
4 6 1 0 0 0 0
4 7 1 0 0 0 0
4 8 1 0 0 0 0
5 9 1 0 0 0 0
5 10 2 0 0 0 0
6 22 1 0 0 0 0
6 23 1 0 0 0 0
6 24 1 0 0 0 0
7 25 1 0 0 0 0
7 26 1 0 0 0 0
7 27 1 0 0 0 0
8 28 1 0 0 0 0
8 29 1 0 0 0 0
8 30 1 0 0 0 0
9 11 2 0 0 0 0
9 31 1 0 0 0 0
10 12 1 0 0 0 0
11 13 1 0 0 0 0
12 13 2 0 0 0 0
12 32 1 0 0 0 0
13 33 1 0 0 0 0
14 15 1 0 0 0 0
14 16 1 0 0 0 0
14 17 2 0 0 0 0
16 18 2 0 0 0 0
16 19 1 0 0 0 0
17 20 1 0 0 0 0
17 35 1 0 0 0 0
18 21 1 0 0 0 0
18 36 1 0 0 0 0
19 37 1 0 0 0 0
19 38 1 0 0 0 0
19 39 1 0 0 0 0
20 21 2 0 0 0 0
20 40 1 0 0 0 0
21 41 1 0 0 0 0
M END
$$$$