D0X9RM
-OEChem-10101305022D
26 28 0 0 0 0 0 0 0999 V2000
6.3551 -1.4328 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 2.1020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.2619 0.3467 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 -0.4580 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.2619 0.3467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.8467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.1533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 1.1515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7619 -0.5193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.3467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.6533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.8467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.1533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7564 -0.6238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9643 -1.6020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0983 -2.1020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8445 0.5588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1542 0.9573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8709 -1.0473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.9667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.2733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 1.1567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -0.4633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1713 -0.1631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5307 -1.8542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0335 -2.7186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 1 0 0 0 0
1 16 1 0 0 0 0
2 8 2 0 0 0 0
3 4 1 0 0 0 0
3 5 1 0 0 0 0
3 8 1 0 0 0 0
4 7 1 0 0 0 0
4 19 1 0 0 0 0
5 9 1 0 0 0 0
5 17 1 0 0 0 0
5 18 1 0 0 0 0
6 7 1 0 0 0 0
6 8 1 0 0 0 0
6 10 2 0 0 0 0
7 11 2 0 0 0 0
9 14 2 0 0 0 0
10 12 1 0 0 0 0
10 20 1 0 0 0 0
11 13 1 0 0 0 0
11 21 1 0 0 0 0
12 13 2 0 0 0 0
12 22 1 0 0 0 0
13 23 1 0 0 0 0
14 15 1 0 0 0 0
14 24 1 0 0 0 0
15 16 2 0 0 0 0
15 25 1 0 0 0 0
16 26 1 0 0 0 0
M END
$$$$