BVM91Y
-OEChem-04012114542D
53 55 0 1 0 0 0 0 0999 V2000
5.4641 -2.1012 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.1012 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
6.5468 5.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.7445 1.2267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.6012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -4.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -4.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 3.3988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.5856 2.5139 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.8988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.8988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 3.8988 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.3776 3.4920 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
5.5686 4.8933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0468 4.2352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5366 2.2049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2798 2.8740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2308 2.5650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -4.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -5.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -5.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9441 4.2365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8958 3.1019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5038 5.5099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9486 4.8933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4616 3.7744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5484 4.5996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 3.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1248 2.0990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1509 3.4805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1951 0.5888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 0.5888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5200 -0.5186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1215 -1.2089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3597 1.9585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.6916 2.9799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -4.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3800 -5.1012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -5.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6200 -5.1012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8441 -5.1012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -5.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0841 -5.1012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 25 1 0 0 0 0
2 26 1 0 0 0 0
3 14 1 0 0 0 0
3 15 1 0 0 0 0
4 17 2 0 0 0 0
5 21 1 0 0 0 0
5 22 1 0 0 0 0
6 27 1 0 0 0 0
6 30 1 0 0 0 0
7 28 1 0 0 0 0
7 31 1 0 0 0 0
12 8 1 6 0 0 0
8 16 1 0 0 0 0
8 38 1 0 0 0 0
13 9 1 6 0 0 0
9 17 1 0 0 0 0
9 39 1 0 0 0 0
10 16 2 0 0 0 0
10 19 1 0 0 0 0
11 16 1 0 0 0 0
11 20 2 0 0 0 0
12 13 1 0 0 0 0
12 14 1 0 0 0 0
12 32 1 0 0 0 0
13 15 1 0 0 0 0
13 33 1 0 0 0 0
14 34 1 0 0 0 0
14 35 1 0 0 0 0
15 36 1 0 0 0 0
15 37 1 0 0 0 0
17 18 1 0 0 0 0
18 24 2 0 0 0 0
18 40 1 0 0 0 0
19 21 2 0 0 0 0
19 41 1 0 0 0 0
20 21 1 0 0 0 0
20 42 1 0 0 0 0
22 23 1 0 0 0 0
22 43 1 0 0 0 0
22 44 1 0 0 0 0
23 25 2 0 0 0 0
23 26 1 0 0 0 0
24 45 1 0 0 0 0
24 46 1 0 0 0 0
25 28 1 0 0 0 0
26 27 2 0 0 0 0
27 29 1 0 0 0 0
28 29 2 0 0 0 0
29 47 1 0 0 0 0
30 48 1 0 0 0 0
30 49 1 0 0 0 0
30 50 1 0 0 0 0
31 51 1 0 0 0 0
31 52 1 0 0 0 0
31 53 1 0 0 0 0
M END
$$$$