B71QRA
-OEChem-04022115533D
39 41 0 0 0 0 0 0 0999 V2000
4.0881 0.4828 0.5823 N 0 0 0 0 0 0 0 0 0 0 0 0
1.7459 -0.0986 -0.1890 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.1739 0.7133 0.8414 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.3168 -0.7911 -1.0187 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.6647 -0.7627 -0.9657 N 0 0 0 0 0 0 0 0 0 0 0 0
6.5547 -0.5493 -0.5977 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0718 0.8755 -0.8433 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0012 -1.0798 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5504 0.9758 -0.7229 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4820 -0.9176 0.7911 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6375 0.6291 0.6999 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3633 -0.0556 -0.1175 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2601 -0.0086 -0.0239 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5151 0.7198 0.8675 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6993 -0.0157 -0.0137 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4036 1.1744 -0.1965 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3897 -1.2121 0.1788 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7985 1.1679 -0.1866 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7845 -1.2187 0.1887 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4890 -0.0287 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6497 -0.5788 -0.5851 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2236 -1.1950 -1.4203 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3872 1.2062 -1.8394 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5430 1.5512 -0.1181 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4674 -0.5418 1.5552 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2666 -2.1369 0.8334 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0888 0.4181 -1.5479 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2682 2.0288 -0.8439 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1494 -1.2537 1.7807 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0187 -1.5805 0.0492 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3727 0.3693 1.7341 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4053 1.6995 0.6157 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1477 -0.6745 -0.9191 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9607 1.3347 1.6413 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8847 2.1172 -0.3531 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8581 -2.1494 0.3262 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.3471 2.0943 -0.3299 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.3223 -2.1502 0.3393 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.5750 -0.0338 0.0136 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 1 0 0 0 0
1 10 1 0 0 0 0
1 11 1 0 0 0 0
2 11 1 0 0 0 0
2 12 1 0 0 0 0
2 33 1 0 0 0 0
3 12 2 0 0 0 0
3 14 1 0 0 0 0
4 5 2 0 0 0 0
4 12 1 0 0 0 0
5 13 1 0 0 0 0
6 7 1 0 0 0 0
6 8 1 0 0 0 0
6 21 1 0 0 0 0
6 22 1 0 0 0 0
7 9 1 0 0 0 0
7 23 1 0 0 0 0
7 24 1 0 0 0 0
8 10 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
13 14 2 0 0 0 0
13 15 1 0 0 0 0
14 34 1 0 0 0 0
15 16 2 0 0 0 0
15 17 1 0 0 0 0
16 18 1 0 0 0 0
16 35 1 0 0 0 0
17 19 2 0 0 0 0
17 36 1 0 0 0 0
18 20 2 0 0 0 0
18 37 1 0 0 0 0
19 20 1 0 0 0 0
19 38 1 0 0 0 0
20 39 1 0 0 0 0
M END
$$$$