BCPE08
-OEChem-04022109143D
29 31 0 0 0 0 0 0 0999 V2000
0.0761 2.2807 -0.0418 S 0 0 0 0 0 0 0 0 0 0 0 0
-4.9491 0.4204 0.2543 S 0 0 0 0 0 0 0 0 0 0 0 0
-2.7368 -1.0244 0.0953 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.4177 1.3305 0.0983 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.0326 -2.6412 0.0078 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9075 -0.1668 -0.3776 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8392 -1.2899 -0.7229 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8603 -1.5663 0.3793 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0295 -0.5771 0.3842 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6647 0.8791 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7752 1.5474 -0.3721 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3443 1.1060 -0.2901 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5293 -0.2840 -0.1685 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1695 1.0519 -0.0321 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3856 -1.3196 -0.0334 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2763 0.2530 0.1363 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3024 -2.2069 -0.9668 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3645 -1.0459 -1.6568 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3759 -1.5840 1.3634 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2752 -2.5692 0.2182 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7502 -0.9091 1.1421 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5534 -0.6285 -0.5786 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6012 1.4483 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1978 0.9480 1.6737 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1673 1.3642 -1.3799 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8378 2.6326 -0.2192 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3695 -1.8160 0.1659 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0724 -2.9212 0.1411 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7647 -3.3282 0.1395 H 0 0 0 0 0 0 0 0 0 0 0 0
1 12 1 0 0 0 0
1 14 1 0 0 0 0
2 16 2 0 0 0 0
3 15 1 0 0 0 0
3 16 1 0 0 0 0
3 27 1 0 0 0 0
4 14 2 0 0 0 0
4 16 1 0 0 0 0
5 15 1 0 0 0 0
5 28 1 0 0 0 0
5 29 1 0 0 0 0
6 7 1 0 0 0 0
6 12 2 0 0 0 0
6 13 1 0 0 0 0
7 8 1 0 0 0 0
7 17 1 0 0 0 0
7 18 1 0 0 0 0
8 9 1 0 0 0 0
8 19 1 0 0 0 0
8 20 1 0 0 0 0
9 10 1 0 0 0 0
9 21 1 0 0 0 0
9 22 1 0 0 0 0
10 11 1 0 0 0 0
10 23 1 0 0 0 0
10 24 1 0 0 0 0
11 12 1 0 0 0 0
11 25 1 0 0 0 0
11 26 1 0 0 0 0
13 14 1 0 0 0 0
13 15 2 0 0 0 0
M END
$$$$