BDTX76
-OEChem-04022112033D
34 35 0 0 0 0 0 0 0999 V2000
2.0296 0.8770 -0.6635 O 0 0 0 0 0 0 0 0 0 0 0 0
5.2051 -0.5661 0.5280 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.3721 -0.1069 0.0994 N 0 0 0 0 0 0 0 0 0 0 0 0
-5.2781 -1.2336 0.2696 N 0 0 0 0 0 0 0 0 0 0 0 0
4.2517 0.4652 0.1201 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9286 -0.1598 -0.2924 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6942 0.6336 -0.4745 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0241 0.1385 -0.0897 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2426 0.0071 1.3845 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8040 -1.2014 -0.6452 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1751 1.6896 -0.2002 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2043 -0.6698 -0.5563 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5341 1.4419 -0.0078 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1547 -0.9174 -0.3638 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3343 0.8244 0.3718 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9859 -1.3275 0.0477 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.5018 0.1051 0.4725 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6474 1.1098 -0.6762 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0365 1.1413 0.9593 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5470 -0.7386 0.5597 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0538 -0.8243 -1.1537 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8032 0.4285 2.2956 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8090 0.7959 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9460 -0.7679 1.7091 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0547 -1.7152 -1.2552 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5192 -1.9724 -0.3357 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3358 -0.4837 -1.2807 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2021 2.7066 -0.1354 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8421 -1.5158 -0.7951 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1595 2.3030 0.2021 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4764 -1.9499 -0.4462 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1633 1.8859 0.4758 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4873 -2.2660 -0.1497 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.4921 0.4832 0.6807 H 0 0 0 0 0 0 0 0 0 0 0 0
1 6 1 0 0 0 0
1 7 1 0 0 0 0
2 5 1 0 0 0 0
2 9 1 0 0 0 0
2 10 1 0 0 0 0
3 8 1 0 0 0 0
3 15 1 0 0 0 0
3 16 1 0 0 0 0
4 16 2 0 0 0 0
4 17 1 0 0 0 0
5 6 1 0 0 0 0
5 18 1 0 0 0 0
5 19 1 0 0 0 0
6 20 1 0 0 0 0
6 21 1 0 0 0 0
7 11 2 0 0 0 0
7 12 1 0 0 0 0
8 13 2 0 0 0 0
8 14 1 0 0 0 0
9 22 1 0 0 0 0
9 23 1 0 0 0 0
9 24 1 0 0 0 0
10 25 1 0 0 0 0
10 26 1 0 0 0 0
10 27 1 0 0 0 0
11 13 1 0 0 0 0
11 28 1 0 0 0 0
12 14 2 0 0 0 0
12 29 1 0 0 0 0
13 30 1 0 0 0 0
14 31 1 0 0 0 0
15 17 2 0 0 0 0
15 32 1 0 0 0 0
16 33 1 0 0 0 0
17 34 1 0 0 0 0
M END
$$$$