B6RS4Q
-OEChem-04012113342D
42 44 0 1 0 0 0 0 0999 V2000
2.8660 0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 0.7500 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
7.1962 -1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -0.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
8.0622 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6592 -1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2742 -0.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6728 -0.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7196 -0.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1181 -0.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6728 0.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2742 1.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5947 1.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7976 1.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6592 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8101 -0.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2087 -0.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 3.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1951 2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 14 2 0 0 0 0
2 9 1 0 0 0 0
2 11 1 0 0 0 0
2 12 1 0 0 0 0
7 3 1 1 0 0 0
3 33 1 0 0 0 0
3 34 1 0 0 0 0
4 12 1 0 0 0 0
4 13 1 0 0 0 0
4 14 1 0 0 0 0
5 12 2 0 0 0 0
5 16 1 0 0 0 0
6 23 3 0 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 24 1 0 0 0 0
8 10 1 0 0 0 0
8 25 1 0 0 0 0
8 26 1 0 0 0 0
9 27 1 0 0 0 0
9 28 1 0 0 0 0
10 11 1 0 0 0 0
10 29 1 0 0 0 0
10 30 1 0 0 0 0
11 31 1 0 0 0 0
11 32 1 0 0 0 0
13 15 1 0 0 0 0
13 35 1 0 0 0 0
13 36 1 0 0 0 0
14 17 1 0 0 0 0
15 18 1 0 0 0 0
15 19 2 0 0 0 0
16 17 2 0 0 0 0
16 37 1 0 0 0 0
17 38 1 0 0 0 0
18 20 2 0 0 0 0
18 23 1 0 0 0 0
19 21 1 0 0 0 0
19 39 1 0 0 0 0
20 22 1 0 0 0 0
20 40 1 0 0 0 0
21 22 2 0 0 0 0
21 41 1 0 0 0 0
22 42 1 0 0 0 0
M END
$$$$