BP64OS
-OEChem-04022100262D
42 43 0 0 0 0 0 0 0999 V2000
5.2693 3.4122 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 3.7694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
3.5032 2.7694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
6.5032 1.7694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.5032 2.7694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
6.1460 1.0034 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
3.5032 1.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.0064 -3.1785 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 -2.2306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.0032 -3.7694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7431 -2.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6942 -2.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 -1.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3122 -2.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3692 0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6372 0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3692 -0.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6372 -0.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5032 1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.1785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5352 -1.5312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0032 -3.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2633 -2.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8721 -3.1158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9062 0.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1003 0.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9062 -1.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1003 -1.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5851 -2.7177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5392 -3.5933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4149 -3.6392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1417 -1.4023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4063 -0.9247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9288 -1.6601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3676 -4.2710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7519 -2.1276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9722 -1.9619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1932 1.2325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5961 -2.9869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 21 1 0 0 0 0
2 21 1 0 0 0 0
3 21 1 0 0 0 0
4 22 1 0 0 0 0
5 22 1 0 0 0 0
6 22 1 0 0 0 0
7 11 1 0 0 0 0
7 41 1 0 0 0 0
8 26 1 0 0 0 0
8 42 1 0 0 0 0
9 13 1 0 0 0 0
9 15 1 0 0 0 0
9 16 1 0 0 0 0
10 13 2 0 0 0 0
10 25 1 0 0 0 0
11 14 1 0 0 0 0
11 21 1 0 0 0 0
11 22 1 0 0 0 0
12 13 1 0 0 0 0
12 23 1 0 0 0 0
12 24 1 0 0 0 0
12 27 1 0 0 0 0
14 17 2 0 0 0 0
14 18 1 0 0 0 0
15 19 2 0 0 0 0
15 20 1 0 0 0 0
16 25 2 0 0 0 0
16 26 1 0 0 0 0
17 19 1 0 0 0 0
17 28 1 0 0 0 0
18 20 2 0 0 0 0
18 29 1 0 0 0 0
19 30 1 0 0 0 0
20 31 1 0 0 0 0
23 32 1 0 0 0 0
23 33 1 0 0 0 0
23 34 1 0 0 0 0
24 35 1 0 0 0 0
24 36 1 0 0 0 0
24 37 1 0 0 0 0
25 38 1 0 0 0 0
26 39 1 0 0 0 0
26 40 1 0 0 0 0
M END
$$$$