B6X1WU
-OEChem-04012117412D
39 40 0 0 0 0 0 0 0999 V2000
3.4030 -0.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 3.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 0.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -0.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7924 1.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1909 0.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8059 0.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0135 1.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6150 2.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -1.5250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5380 -2.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9264 2.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3249 2.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2700 -0.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5380 -3.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 1.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -4.5250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2700 0.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 3.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 7 2 0 0 0 0
2 14 1 0 0 0 0
2 39 1 0 0 0 0
3 7 1 0 0 0 0
3 8 1 0 0 0 0
3 24 1 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 21 1 0 0 0 0
5 10 2 0 0 0 0
5 12 1 0 0 0 0
6 11 2 0 0 0 0
6 13 1 0 0 0 0
8 9 1 0 0 0 0
8 22 1 0 0 0 0
8 23 1 0 0 0 0
9 14 1 0 0 0 0
9 25 1 0 0 0 0
9 26 1 0 0 0 0
10 15 1 0 0 0 0
10 27 1 0 0 0 0
11 16 1 0 0 0 0
11 28 1 0 0 0 0
12 17 2 0 0 0 0
12 29 1 0 0 0 0
13 18 2 0 0 0 0
13 30 1 0 0 0 0
14 31 1 0 0 0 0
14 32 1 0 0 0 0
15 19 2 0 0 0 0
15 33 1 0 0 0 0
16 20 2 0 0 0 0
16 34 1 0 0 0 0
17 19 1 0 0 0 0
17 35 1 0 0 0 0
18 20 1 0 0 0 0
18 36 1 0 0 0 0
19 37 1 0 0 0 0
20 38 1 0 0 0 0
M END
$$$$