BT7D1M
-OEChem-04012112402D
38 41 0 1 0 0 0 0 0999 V2000
7.0555 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.5998 -0.3047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8490 -0.7743 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.1895 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.3490 0.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3235 -0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
3.9010 1.4810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.5377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0647 -1.4659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8073 1.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5000 -1.4038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0555 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9216 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7876 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9216 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.6536 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.6536 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7876 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.5998 1.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.1834 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8980 0.5171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8154 -0.8774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1521 2.0478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3294 1.7210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7217 0.0163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4543 -0.8320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8050 -2.0289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6477 -1.6767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3610 0.7794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0778 1.6162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9543 -1.6980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7783 -1.9578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1895 0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7876 -1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3846 1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7876 2.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.7924 1.8940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.8034 0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 12 2 0 0 0 0
2 16 1 0 0 0 0
2 20 1 0 0 0 0
3 9 1 0 0 0 0
3 10 1 0 0 0 0
3 11 1 0 0 0 0
6 4 1 1 0 0 0
4 12 1 0 0 0 0
4 33 1 0 0 0 0
5 6 1 0 0 0 0
5 7 1 0 0 0 0
5 8 1 0 0 0 0
5 21 1 0 0 0 0
6 9 1 0 0 0 0
6 22 1 0 0 0 0
7 10 1 0 0 0 0
7 23 1 0 0 0 0
7 24 1 0 0 0 0
8 11 1 0 0 0 0
8 25 1 0 0 0 0
8 26 1 0 0 0 0
9 27 1 0 0 0 0
9 28 1 0 0 0 0
10 29 1 0 0 0 0
10 30 1 0 0 0 0
11 31 1 0 0 0 0
11 32 1 0 0 0 0
12 13 1 0 0 0 0
13 14 2 0 0 0 0
13 15 1 0 0 0 0
14 16 1 0 0 0 0
14 34 1 0 0 0 0
15 18 2 0 0 0 0
15 35 1 0 0 0 0
16 17 2 0 0 0 0
17 18 1 0 0 0 0
17 19 1 0 0 0 0
18 36 1 0 0 0 0
19 20 2 0 0 0 0
19 37 1 0 0 0 0
20 38 1 0 0 0 0
M END
$$$$