D00FGB
-OEChem-10101305022D
31 32 0 1 0 0 0 0 0999 V2000
3.4030 0.8060 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
2.9030 -0.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9030 1.6720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.5309 -1.9260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.5309 -0.1940 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 1.3060 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.5309 -0.1940 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
6.9473 0.6108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9473 -0.9987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 0.3060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -0.6940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 0.8060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -1.1940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 0.3060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -0.6940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0309 -1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.0309 -1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9171 -0.9512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4846 0.9200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6962 1.1777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6962 -1.5656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4846 -1.3079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 1.4260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8409 0.3430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -1.8140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.0040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0309 -1.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.6509 -1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0309 -0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.9960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 1.9260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
1 3 2 0 0 0 0
1 6 1 0 0 0 0
1 14 1 0 0 0 0
4 16 2 0 0 0 0
5 7 1 0 0 0 0
5 16 1 0 0 0 0
5 24 1 0 0 0 0
6 30 1 0 0 0 0
6 31 1 0 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 18 1 0 0 0 0
8 10 1 0 0 0 0
8 19 1 0 0 0 0
8 20 1 0 0 0 0
9 11 1 0 0 0 0
9 21 1 0 0 0 0
9 22 1 0 0 0 0
10 11 2 0 0 0 0
10 12 1 0 0 0 0
11 13 1 0 0 0 0
12 14 2 0 0 0 0
12 23 1 0 0 0 0
13 15 2 0 0 0 0
13 25 1 0 0 0 0
14 15 1 0 0 0 0
15 26 1 0 0 0 0
16 17 1 0 0 0 0
17 27 1 0 0 0 0
17 28 1 0 0 0 0
17 29 1 0 0 0 0
M END
$$$$