BG9C8P
-OEChem-04022100222D
38 40 0 1 0 0 0 0 0999 V2000
4.1760 1.1855 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 0.6855 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.7638 -0.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.7906 -2.2838 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4000 -0.8214 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.3100 0.6855 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
4.1760 -0.8145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3100 -0.3145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0420 -0.3145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0420 0.6855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1921 -1.8560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8100 1.5515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9015 -0.8093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0692 -2.3188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9150 -1.8009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2940 -2.3838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3920 -1.8630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3100 2.4175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8100 3.2836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6335 -0.7965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8103 -3.2836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6526 0.5778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2541 1.2681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3350 1.9500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3350 1.1530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0890 -2.9385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2964 -3.0038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.2224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8538 -2.1709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9300 2.4175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1200 3.8205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1900 3.2836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3275 -1.3357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1727 -1.1025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9395 -0.2573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1905 -3.2958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8226 -3.9034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4302 -3.2714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 6 1 0 0 0 0
1 10 1 0 0 0 0
2 6 1 0 0 0 0
2 28 1 0 0 0 0
3 13 1 0 0 0 0
3 20 1 0 0 0 0
4 15 1 0 0 0 0
4 21 1 0 0 0 0
5 8 2 0 0 0 0
5 17 1 0 0 0 0
6 8 1 0 0 0 0
6 12 1 0 0 0 0
7 8 1 0 0 0 0
7 9 2 0 0 0 0
7 11 1 0 0 0 0
9 10 1 0 0 0 0
9 13 1 0 0 0 0
10 22 1 0 0 0 0
10 23 1 0 0 0 0
11 14 2 0 0 0 0
11 16 1 0 0 0 0
12 18 1 0 0 0 0
12 24 1 0 0 0 0
12 25 1 0 0 0 0
13 15 2 0 0 0 0
14 15 1 0 0 0 0
14 26 1 0 0 0 0
16 17 2 0 0 0 0
16 27 1 0 0 0 0
17 29 1 0 0 0 0
18 19 2 0 0 0 0
18 30 1 0 0 0 0
19 31 1 0 0 0 0
19 32 1 0 0 0 0
20 33 1 0 0 0 0
20 34 1 0 0 0 0
20 35 1 0 0 0 0
21 36 1 0 0 0 0
21 37 1 0 0 0 0
21 38 1 0 0 0 0
M END
$$$$