BV9MK1
-OEChem-04022102102D
37 39 0 0 0 0 0 0 0999 V2000
3.6750 -0.8087 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
4.1349 2.6739 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.9538 0.9514 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.3660 0.1424 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0570 -0.8087 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.3104 4.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7172 3.3784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3159 4.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1294 2.5694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7281 3.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5471 1.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3660 0.1424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.8965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.8965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.8965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.8965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -4.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1478 2.9324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2312 3.7251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4868 4.9925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7587 4.6683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9120 4.4420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2672 4.9104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9585 1.9734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6866 2.2976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2974 4.0335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2141 3.2408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1164 2.3109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0331 1.5182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5704 0.8866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -2.5865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.5865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -4.2065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -4.2065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -5.0165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 12 1 0 0 0 0
1 13 1 0 0 0 0
2 9 1 0 0 0 0
2 10 1 0 0 0 0
2 11 1 0 0 0 0
3 11 1 0 0 0 0
3 12 1 0 0 0 0
3 32 1 0 0 0 0
4 5 1 0 0 0 0
4 12 2 0 0 0 0
5 13 2 0 0 0 0
6 7 1 0 0 0 0
6 8 1 0 0 0 0
6 24 1 0 0 0 0
6 25 1 0 0 0 0
7 9 1 0 0 0 0
7 20 1 0 0 0 0
7 21 1 0 0 0 0
8 10 1 0 0 0 0
8 22 1 0 0 0 0
8 23 1 0 0 0 0
9 26 1 0 0 0 0
9 27 1 0 0 0 0
10 28 1 0 0 0 0
10 29 1 0 0 0 0
11 30 1 0 0 0 0
11 31 1 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
14 16 1 0 0 0 0
15 17 1 0 0 0 0
15 33 1 0 0 0 0
16 18 2 0 0 0 0
16 34 1 0 0 0 0
17 19 2 0 0 0 0
17 35 1 0 0 0 0
18 19 1 0 0 0 0
18 36 1 0 0 0 0
19 37 1 0 0 0 0
M END
$$$$