D0S4SQ
-OEChem-10101305032D
39 41 0 0 0 0 0 0 0999 V2000
11.0314 2.9704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -3.0983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.1424 -0.2936 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.0983 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.1424 -1.9030 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.5983 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.0983 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.4530 0.6570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4315 0.8632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -0.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7422 1.8137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -1.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7260 -1.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7207 2.0199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -2.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4325 1.2766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8392 0.7443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4521 0.2435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0454 0.7758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.7216 2.4334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1284 1.9010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3460 -1.0983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 0.5217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.7413 1.4003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.3345 1.9326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.5217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.6380 3.0983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.5217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -1.9083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -0.2883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.7183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -1.9083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 14 1 0 0 0 0
1 34 1 0 0 0 0
2 16 2 0 0 0 0
3 8 1 0 0 0 0
3 10 1 0 0 0 0
3 13 1 0 0 0 0
4 10 1 0 0 0 0
4 15 1 0 0 0 0
4 30 1 0 0 0 0
5 12 1 0 0 0 0
5 13 2 0 0 0 0
6 15 2 0 0 0 0
6 16 1 0 0 0 0
7 15 1 0 0 0 0
7 17 1 0 0 0 0
7 33 1 0 0 0 0
8 9 1 0 0 0 0
8 23 1 0 0 0 0
8 24 1 0 0 0 0
9 11 1 0 0 0 0
9 25 1 0 0 0 0
9 26 1 0 0 0 0
10 12 2 0 0 0 0
11 14 1 0 0 0 0
11 27 1 0 0 0 0
11 28 1 0 0 0 0
12 16 1 0 0 0 0
13 29 1 0 0 0 0
14 31 1 0 0 0 0
14 32 1 0 0 0 0
17 18 2 0 0 0 0
17 19 1 0 0 0 0
18 20 1 0 0 0 0
18 35 1 0 0 0 0
19 21 2 0 0 0 0
19 36 1 0 0 0 0
20 22 2 0 0 0 0
20 37 1 0 0 0 0
21 22 1 0 0 0 0
21 38 1 0 0 0 0
22 39 1 0 0 0 0
M END
$$$$