BD8Q5U
-OEChem-04022100262D
41 42 0 0 0 0 0 0 0999 V2000
5.2693 4.2212 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 4.5784 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
3.5032 3.5784 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
6.5032 2.5784 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.5032 3.5784 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
6.1460 1.8124 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
6.1788 -4.5784 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
4.7820 -4.3572 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
6.4000 -3.1816 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
3.5032 2.5784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 -1.4216 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.0032 -2.9604 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 2.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7431 -1.7003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 1.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6942 -2.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 -0.4216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3692 1.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6372 1.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3692 0.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6372 0.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 3.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5032 2.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3122 -2.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0032 -2.9604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.3695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5352 -0.7222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5910 -3.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2039 -1.2855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9062 1.3884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1003 1.3884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9062 -0.2316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1003 -0.2316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9019 -1.8178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5851 -1.9087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5392 -2.7843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4149 -2.8302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1417 -0.5933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4063 -0.1157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9288 -0.8511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1932 2.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 22 1 0 0 0 0
2 22 1 0 0 0 0
3 22 1 0 0 0 0
4 23 1 0 0 0 0
5 23 1 0 0 0 0
6 23 1 0 0 0 0
7 28 1 0 0 0 0
8 28 1 0 0 0 0
9 28 1 0 0 0 0
10 13 1 0 0 0 0
10 41 1 0 0 0 0
11 16 1 0 0 0 0
11 17 1 0 0 0 0
11 24 1 0 0 0 0
12 16 2 0 0 0 0
12 25 1 0 0 0 0
13 15 1 0 0 0 0
13 22 1 0 0 0 0
13 23 1 0 0 0 0
14 16 1 0 0 0 0
14 26 1 0 0 0 0
14 27 1 0 0 0 0
14 29 1 0 0 0 0
15 18 2 0 0 0 0
15 19 1 0 0 0 0
17 20 2 0 0 0 0
17 21 1 0 0 0 0
18 20 1 0 0 0 0
18 30 1 0 0 0 0
19 21 2 0 0 0 0
19 31 1 0 0 0 0
20 32 1 0 0 0 0
21 33 1 0 0 0 0
24 25 2 0 0 0 0
24 34 1 0 0 0 0
25 28 1 0 0 0 0
26 35 1 0 0 0 0
26 36 1 0 0 0 0
26 37 1 0 0 0 0
27 38 1 0 0 0 0
27 39 1 0 0 0 0
27 40 1 0 0 0 0
M END
$$$$