BS74IE
-OEChem-04012112532D
44 46 0 0 0 0 0 0 0999 V2000
6.4641 1.7500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.7500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
4.4641 1.7500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
11.5263 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
10.6603 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5263 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6603 -1.2500 0.0000 C 0 0 0 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
5.4641 0.7500 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
4.5981 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.7500 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
2.8660 -0.7500 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
2.0000 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.0588 1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.2617 1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1836 -0.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5822 -1.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3267 1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5297 1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.1369 0.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.7383 0.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.2617 -1.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.0588 -1.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6636 -0.2249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4607 -0.2249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 1.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 19 1 0 0 0 0
2 19 1 0 0 0 0
3 19 1 0 0 0 0
4 12 1 0 0 0 0
4 13 1 0 0 0 0
5 9 1 0 0 0 0
5 10 1 0 0 0 0
5 11 1 0 0 0 0
6 14 1 0 0 0 0
6 15 1 0 0 0 0
6 38 1 0 0 0 0
7 8 1 0 0 0 0
7 15 2 0 0 0 0
8 18 2 0 0 0 0
9 12 1 0 0 0 0
9 26 1 0 0 0 0
9 27 1 0 0 0 0
10 13 1 0 0 0 0
10 28 1 0 0 0 0
10 29 1 0 0 0 0
11 14 1 0 0 0 0
11 30 1 0 0 0 0
11 31 1 0 0 0 0
12 32 1 0 0 0 0
12 33 1 0 0 0 0
13 34 1 0 0 0 0
13 35 1 0 0 0 0
14 36 1 0 0 0 0
14 37 1 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
16 19 1 0 0 0 0
17 18 1 0 0 0 0
17 39 1 0 0 0 0
18 20 1 0 0 0 0
20 21 2 0 0 0 0
20 22 1 0 0 0 0
21 23 1 0 0 0 0
21 40 1 0 0 0 0
22 24 2 0 0 0 0
22 41 1 0 0 0 0
23 25 2 0 0 0 0
23 42 1 0 0 0 0
24 25 1 0 0 0 0
24 43 1 0 0 0 0
25 44 1 0 0 0 0
M END
$$$$