BD5Z0O
-OEChem-04012116012D
39 42 0 0 0 0 0 0 0999 V2000
2.7099 -0.6052 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
3.0778 2.8957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0948 0.5163 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.6166 1.1744 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.6096 0.2061 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.1993 1.5108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8379 -0.1528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1166 0.3084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2857 1.9176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0653 2.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6300 -1.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9313 1.5108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6634 1.5108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7974 2.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6634 0.5108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9313 0.5108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6789 -1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3731 -1.8001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7974 0.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6096 1.8155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4710 -2.4181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1652 -2.7783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1932 1.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2142 -3.0873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4128 -0.3851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1664 0.3729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0653 2.6308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.2392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7974 2.6308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3944 0.2008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2182 -1.0252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9628 -1.6085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7974 -0.6092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8022 2.4049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8814 -2.6098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6260 -3.1931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.8132 1.0108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4882 3.0873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0853 -3.6937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 8 2 0 0 0 0
2 9 1 0 0 0 0
2 38 1 0 0 0 0
3 6 1 0 0 0 0
3 7 1 0 0 0 0
3 8 1 0 0 0 0
4 8 1 0 0 0 0
4 9 1 0 0 0 0
4 28 1 0 0 0 0
5 15 2 0 0 0 0
5 23 1 0 0 0 0
6 9 2 0 0 0 0
6 10 1 0 0 0 0
7 11 1 0 0 0 0
7 25 1 0 0 0 0
7 26 1 0 0 0 0
10 12 2 0 0 0 0
10 27 1 0 0 0 0
11 17 2 0 0 0 0
11 18 1 0 0 0 0
12 14 1 0 0 0 0
12 16 1 0 0 0 0
13 14 2 0 0 0 0
13 15 1 0 0 0 0
13 20 1 0 0 0 0
14 29 1 0 0 0 0
15 19 1 0 0 0 0
16 19 2 0 0 0 0
16 30 1 0 0 0 0
17 21 1 0 0 0 0
17 31 1 0 0 0 0
18 22 2 0 0 0 0
18 32 1 0 0 0 0
19 33 1 0 0 0 0
20 23 2 0 0 0 0
20 34 1 0 0 0 0
21 24 2 0 0 0 0
21 35 1 0 0 0 0
22 24 1 0 0 0 0
22 36 1 0 0 0 0
23 37 1 0 0 0 0
24 39 1 0 0 0 0
M END
$$$$