BSP05N
-OEChem-04012117412D
39 41 0 0 0 0 0 0 0999 V2000
5.9717 4.1302 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
2.6166 -2.6996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2396 0.1302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.9717 4.1302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.9717 4.1302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.9717 0.1302 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.9147 -1.9576 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.6056 -2.9086 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.9717 5.1302 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6056 -2.9086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1056 -1.3698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9717 1.1302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9717 3.1302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0179 -3.7176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2966 -1.9576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1056 -0.3698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1056 1.6302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8377 1.6302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1056 2.6302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8377 2.6302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0233 -3.6131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4246 -4.6312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4356 -4.4221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8368 -5.4402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8423 -5.3357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7070 -1.7660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5086 -0.1798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5687 1.3202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3746 1.3202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5687 2.9402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3746 2.9402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5043 -1.7660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0412 -4.6960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8190 -4.3573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0890 -6.0066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4779 -5.8373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5086 5.4402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4347 5.4402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.6348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 4 2 0 0 0 0
1 5 2 0 0 0 0
1 9 1 0 0 0 0
1 13 1 0 0 0 0
2 21 1 0 0 0 0
2 39 1 0 0 0 0
3 16 2 0 0 0 0
6 12 1 0 0 0 0
6 16 1 0 0 0 0
6 27 1 0 0 0 0
7 8 1 0 0 0 0
7 11 1 0 0 0 0
7 32 1 0 0 0 0
8 10 2 0 0 0 0
9 37 1 0 0 0 0
9 38 1 0 0 0 0
10 14 1 0 0 0 0
10 15 1 0 0 0 0
11 15 2 0 0 0 0
11 16 1 0 0 0 0
12 17 2 0 0 0 0
12 18 1 0 0 0 0
13 19 2 0 0 0 0
13 20 1 0 0 0 0
14 21 1 0 0 0 0
14 22 2 0 0 0 0
15 26 1 0 0 0 0
17 19 1 0 0 0 0
17 28 1 0 0 0 0
18 20 2 0 0 0 0
18 29 1 0 0 0 0
19 30 1 0 0 0 0
20 31 1 0 0 0 0
21 23 2 0 0 0 0
22 24 1 0 0 0 0
22 33 1 0 0 0 0
23 25 1 0 0 0 0
23 34 1 0 0 0 0
24 25 2 0 0 0 0
24 35 1 0 0 0 0
25 36 1 0 0 0 0
M END
$$$$