BD2WL1
-OEChem-04022103223D
38 42 0 0 0 0 0 0 0999 V2000
-4.9399 -1.4323 -1.3879 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0617 -0.7661 0.2754 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.8709 0.5508 -0.9968 N 0 0 0 0 0 0 0 0 0 0 0 0
1.1148 0.0833 0.0961 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.3550 -3.1324 0.4782 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.9525 1.8517 0.9385 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.3108 -0.4445 0.3775 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1950 -1.4496 0.5155 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6661 -1.2937 0.6269 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7850 0.9643 0.3285 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5068 -2.0917 0.3271 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9176 1.3905 -0.3793 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6097 -2.8188 0.5614 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1888 -0.7015 0.0583 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8761 -2.0569 0.1966 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1920 -0.7524 -0.6815 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5008 -0.1348 -0.1139 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1184 2.7694 -0.5295 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2613 3.6781 0.0748 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2090 3.1711 0.8059 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4964 -0.8667 -0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7768 1.1453 0.3661 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7682 -0.3185 -0.9281 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0485 1.6937 0.1991 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0442 0.9617 -0.4479 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1594 -2.2511 0.8292 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9420 -0.6222 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3362 -3.6397 0.6807 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5347 -2.9142 0.2044 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4258 0.9763 -1.7355 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9663 3.1470 -1.0971 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4206 4.7459 -0.0174 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5113 3.8301 1.3115 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3097 -1.8623 -1.1555 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0242 1.7371 0.8818 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5430 -0.8872 -1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2643 2.6898 0.5743 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0343 1.3887 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0
1 16 2 0 0 0 0
2 4 1 0 0 0 0
2 7 1 0 0 0 0
2 11 1 0 0 0 0
3 12 1 0 0 0 0
3 16 1 0 0 0 0
3 30 1 0 0 0 0
4 14 2 0 0 0 0
5 11 1 0 0 0 0
5 13 2 0 0 0 0
6 10 1 0 0 0 0
6 20 2 0 0 0 0
7 8 2 0 0 0 0
7 10 1 0 0 0 0
8 9 1 0 0 0 0
8 13 1 0 0 0 0
9 16 1 0 0 0 0
9 26 1 0 0 0 0
9 27 1 0 0 0 0
10 12 2 0 0 0 0
11 15 2 0 0 0 0
12 18 1 0 0 0 0
13 28 1 0 0 0 0
14 15 1 0 0 0 0
14 17 1 0 0 0 0
15 29 1 0 0 0 0
17 21 2 0 0 0 0
17 22 1 0 0 0 0
18 19 2 0 0 0 0
18 31 1 0 0 0 0
19 20 1 0 0 0 0
19 32 1 0 0 0 0
20 33 1 0 0 0 0
21 23 1 0 0 0 0
21 34 1 0 0 0 0
22 24 2 0 0 0 0
22 35 1 0 0 0 0
23 25 2 0 0 0 0
23 36 1 0 0 0 0
24 25 1 0 0 0 0
24 37 1 0 0 0 0
25 38 1 0 0 0 0
M END
$$$$