BHQ0N6
-OEChem-04012114072D
43 46 0 1 0 0 0 0 0999 V2000
5.8042 0.2003 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
9.2399 3.0784 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
7.8431 2.8572 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
9.4611 1.6816 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
9.3765 -1.2737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.3765 -2.8832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4952 1.1514 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.1132 -0.7507 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.7553 0.5093 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
7.0643 1.4604 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.5643 -0.0784 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
8.3733 0.5093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5643 -1.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0643 1.4604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4303 -1.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6983 -1.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8532 -0.1087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6521 2.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4303 -2.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6983 -2.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5643 -3.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.9602 -2.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1100 0.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6453 -1.0868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1590 0.2514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6942 -1.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9511 -0.7267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1167 -0.3599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6833 -0.0276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9397 0.7615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1613 -1.2684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1613 -2.8884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5643 -3.6984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.4210 -2.4932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.4210 -1.6637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2389 1.1669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1060 -1.5017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6982 0.6663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5653 -2.0023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8084 -0.4461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4103 -1.2273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1916 -1.6254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 7 2 0 0 0 0
1 8 2 0 0 0 0
1 9 1 0 0 0 0
1 17 1 0 0 0 0
2 18 1 0 0 0 0
3 18 1 0 0 0 0
4 18 1 0 0 0 0
5 15 1 0 0 0 0
5 22 1 0 0 0 0
6 19 1 0 0 0 0
6 22 1 0 0 0 0
9 10 1 0 0 0 0
9 11 1 0 0 0 0
10 14 2 0 0 0 0
11 12 1 0 0 0 0
11 13 1 0 0 0 0
11 29 1 0 0 0 0
12 14 1 0 0 0 0
12 30 1 0 0 0 0
12 31 1 0 0 0 0
13 15 2 0 0 0 0
13 16 1 0 0 0 0
14 18 1 0 0 0 0
15 19 1 0 0 0 0
16 20 2 0 0 0 0
16 32 1 0 0 0 0
17 23 2 0 0 0 0
17 24 1 0 0 0 0
19 21 2 0 0 0 0
20 21 1 0 0 0 0
20 33 1 0 0 0 0
21 34 1 0 0 0 0
22 35 1 0 0 0 0
22 36 1 0 0 0 0
23 25 1 0 0 0 0
23 37 1 0 0 0 0
24 26 2 0 0 0 0
24 38 1 0 0 0 0
25 27 2 0 0 0 0
25 39 1 0 0 0 0
26 27 1 0 0 0 0
26 40 1 0 0 0 0
27 28 1 0 0 0 0
28 41 1 0 0 0 0
28 42 1 0 0 0 0
28 43 1 0 0 0 0
M END
$$$$