BVL5C1
-OEChem-04022104522D
46 49 0 0 0 0 0 0 0999 V2000
13.3263 2.9330 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 -2.0670 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
5.1660 -2.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1660 -2.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 0.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 -0.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.8622 -0.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 -1.5670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 0.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.8000 -1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8000 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9061 -2.1016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9061 -0.0323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.5878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.5462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9962 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9962 2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8622 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7282 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7282 2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5942 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5942 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.4603 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.4603 2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0690 -1.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9132 -2.7216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9132 0.5876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4643 -1.8999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4643 -0.2341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8612 1.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 0.3130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1291 1.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7272 2.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5331 2.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 3.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1913 2.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.5942 0.3130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.5942 3.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.9972 1.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 31 1 0 0 0 0
2 3 2 0 0 0 0
2 4 2 0 0 0 0
2 8 1 0 0 0 0
2 10 1 0 0 0 0
5 13 1 0 0 0 0
5 39 1 0 0 0 0
6 16 2 0 0 0 0
7 24 2 0 0 0 0
8 12 1 0 0 0 0
8 32 1 0 0 0 0
9 16 1 0 0 0 0
9 19 1 0 0 0 0
9 37 1 0 0 0 0
10 11 1 0 0 0 0
10 14 2 0 0 0 0
11 13 1 0 0 0 0
11 15 2 0 0 0 0
12 13 2 0 0 0 0
12 16 1 0 0 0 0
14 17 1 0 0 0 0
14 33 1 0 0 0 0
15 18 1 0 0 0 0
15 34 1 0 0 0 0
17 18 2 0 0 0 0
17 35 1 0 0 0 0
18 36 1 0 0 0 0
19 21 1 0 0 0 0
19 22 2 0 0 0 0
20 21 2 0 0 0 0
20 23 1 0 0 0 0
20 24 1 0 0 0 0
21 38 1 0 0 0 0
22 25 1 0 0 0 0
22 40 1 0 0 0 0
23 25 2 0 0 0 0
23 41 1 0 0 0 0
24 26 1 0 0 0 0
25 42 1 0 0 0 0
26 27 2 0 0 0 0
26 28 1 0 0 0 0
27 29 1 0 0 0 0
27 43 1 0 0 0 0
28 30 2 0 0 0 0
28 44 1 0 0 0 0
29 31 2 0 0 0 0
29 45 1 0 0 0 0
30 31 1 0 0 0 0
30 46 1 0 0 0 0
M END
$$$$