D0Q7KI
-OEChem-09301911203D
28 30 0 0 0 0 0 0 0999 V2000
4.4768 0.5779 0.0784 S 0 0 0 0 0 0 0 0 0 0 0 0
-0.9579 1.6887 0.0398 S 0 0 0 0 0 0 0 0 0 0 0 0
3.3959 -2.1784 0.0330 F 0 0 0 0 0 0 0 0 0 0 0 0
4.5771 1.9064 0.6643 O 0 0 0 0 0 0 0 0 0 0 0 0
5.2493 -0.5214 0.6381 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2788 -0.8702 0.0032 N 0 0 0 0 0 0 0 0 0 0 0 0
-5.5183 -0.1850 -0.0297 N 0 0 0 0 0 0 0 0 0 0 0 0
4.8053 0.6851 -1.5944 N 0 0 0 0 0 0 0 0 0 0 0 0
-5.5303 1.1587 -0.0117 N 0 0 0 0 0 0 0 0 0 0 0 0
-4.1002 -2.0625 -0.0411 N 0 0 0 0 0 0 0 0 0 0 0 0
0.4619 0.7103 0.0407 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0887 -0.6370 0.0199 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7915 0.1130 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8089 1.1063 0.0588 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9202 0.2750 0.0124 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1016 -1.6206 0.0176 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4447 -1.2335 0.0357 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3981 0.3393 -0.0016 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2659 -0.7252 -0.0246 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2323 1.4732 0.0055 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0659 2.1612 0.0677 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8420 -2.6753 0.0016 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9625 2.5199 0.0223 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.4050 -0.6730 -0.0451 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9459 1.6210 -1.9939 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4044 -0.0385 -2.0103 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1795 -2.4903 -0.0378 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8835 -2.7084 -0.0576 H 0 0 0 0 0 0 0 0 0 0 0 0
1 4 2 0 0 0 0
1 5 2 0 0 0 0
1 8 1 0 0 0 0
1 13 1 0 0 0 0
2 11 1 0 0 0 0
2 15 1 0 0 0 0
3 17 1 0 0 0 0
6 12 1 0 0 0 0
6 15 2 0 0 0 0
7 9 1 0 0 0 0
7 19 1 0 0 0 0
7 24 1 0 0 0 0
8 25 1 0 0 0 0
8 26 1 0 0 0 0
9 20 2 0 0 0 0
10 19 1 0 0 0 0
10 27 1 0 0 0 0
10 28 1 0 0 0 0
11 12 1 0 0 0 0
11 14 2 0 0 0 0
12 16 2 0 0 0 0
13 14 1 0 0 0 0
13 17 2 0 0 0 0
14 21 1 0 0 0 0
15 18 1 0 0 0 0
16 17 1 0 0 0 0
16 22 1 0 0 0 0
18 19 2 0 0 0 0
18 20 1 0 0 0 0
20 23 1 0 0 0 0
M END
$$$$