D0R4FM
-OEChem-10101305022D
33 35 0 1 0 0 0 0 0999 V2000
6.3301 0.6154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.3846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -2.3846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.0785 -2.4192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.8602 0.6395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.1154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.1154 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.4641 -0.8846 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.5981 0.6154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -1.3846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -0.8846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 0.1154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0901 -1.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0901 0.6501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.6154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.1154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9962 -0.9054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9962 0.1362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 2.1154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.6154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.6154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.7354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.5046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0829 1.2700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 1.9254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.5046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.0046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5319 -1.2175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 2.7354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 0.3054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6118 -2.7354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3984 0.3316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.7354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 7 1 0 0 0 0
1 12 1 0 0 0 0
8 2 1 6 0 0 0
2 27 1 0 0 0 0
3 10 2 0 0 0 0
4 13 1 0 0 0 0
4 31 1 0 0 0 0
5 18 1 0 0 0 0
5 32 1 0 0 0 0
6 21 1 0 0 0 0
6 33 1 0 0 0 0
7 8 1 0 0 0 0
7 9 1 1 0 0 0
7 22 1 0 0 0 0
8 10 1 0 0 0 0
8 23 1 0 0 0 0
9 15 2 0 0 0 0
9 16 1 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
11 13 2 0 0 0 0
12 14 2 0 0 0 0
13 17 1 0 0 0 0
14 18 1 0 0 0 0
14 24 1 0 0 0 0
15 19 1 0 0 0 0
15 25 1 0 0 0 0
16 20 2 0 0 0 0
16 26 1 0 0 0 0
17 18 2 0 0 0 0
17 28 1 0 0 0 0
19 21 2 0 0 0 0
19 29 1 0 0 0 0
20 21 1 0 0 0 0
20 30 1 0 0 0 0
M END
$$$$