B39BMJ
-OEChem-04022107453D
33 35 0 0 0 0 0 0 0999 V2000
4.8231 -0.2058 0.0973 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4666 0.0565 -2.3142 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5196 1.7168 0.0726 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.1855 1.8949 0.0864 N 0 0 0 0 0 0 0 0 0 0 0 0
-4.1475 -0.0748 0.0227 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.0762 -2.2661 -0.0155 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.7055 -2.5432 -0.0026 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.7205 -0.3264 0.0355 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7046 0.6471 0.0635 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8943 0.4064 0.0422 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7199 0.4283 0.0692 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8402 -1.7119 0.0054 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4175 0.3471 -1.1359 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4008 0.2967 1.2795 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3916 2.8673 0.0906 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7962 0.1346 -1.1308 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7794 0.0839 1.2845 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4771 0.0030 0.0794 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1379 -1.4250 -0.0057 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4429 -0.3295 1.3759 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8882 0.4486 -2.0812 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8703 0.3568 2.2271 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1920 3.4337 1.0038 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1750 3.4747 -0.7919 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4357 2.5472 0.0733 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2416 -0.0094 2.2612 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1121 -1.9017 -0.0232 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2279 -2.1593 0.0123 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8374 -3.5455 -0.0247 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8347 0.1697 -3.0449 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5119 -0.4907 1.2016 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0741 -1.2055 1.9201 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3518 0.5929 1.9595 H 0 0 0 0 0 0 0 0 0 0 0 0
1 18 1 0 0 0 0
1 20 1 0 0 0 0
2 16 1 0 0 0 0
2 30 1 0 0 0 0
3 4 1 0 0 0 0
3 10 1 0 0 0 0
3 15 1 0 0 0 0
4 9 2 0 0 0 0
5 10 2 0 0 0 0
5 19 1 0 0 0 0
6 12 1 0 0 0 0
6 19 2 0 0 0 0
7 12 1 0 0 0 0
7 28 1 0 0 0 0
7 29 1 0 0 0 0
8 9 1 0 0 0 0
8 10 1 0 0 0 0
8 12 2 0 0 0 0
9 11 1 0 0 0 0
11 13 2 0 0 0 0
11 14 1 0 0 0 0
13 16 1 0 0 0 0
13 21 1 0 0 0 0
14 17 2 0 0 0 0
14 22 1 0 0 0 0
15 23 1 0 0 0 0
15 24 1 0 0 0 0
15 25 1 0 0 0 0
16 18 2 0 0 0 0
17 18 1 0 0 0 0
17 26 1 0 0 0 0
19 27 1 0 0 0 0
20 31 1 0 0 0 0
20 32 1 0 0 0 0
20 33 1 0 0 0 0
M END
$$$$