L7YOD0
-OEChem-05022323012D
56 59 0 0 0 0 0 0 0999 V2000
6.1350 -2.5173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.8671 0.4827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5369 -1.0173 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
2.5369 0.7147 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
14.8632 1.4619 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.0369 -0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5369 0.7147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0369 -0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4030 -1.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2690 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1350 -1.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2690 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0010 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1350 0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0010 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0010 -3.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7331 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5991 0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.0632 1.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.0632 2.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.3312 1.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.1972 0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.1972 2.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.3312 2.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.4651 0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.9572 3.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.9572 0.9480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.8632 2.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5369 -2.0173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5119 -0.5498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5119 0.2472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9543 -1.2294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6446 -1.6279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1196 0.9268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4293 1.3253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5620 0.2472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5620 -0.5498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.0247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 1.3347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0044 -1.9923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8015 -1.9923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7320 0.2927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5380 -1.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1350 1.1027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6910 -3.5543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5380 -3.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3110 -2.4804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3346 -0.4923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1316 -0.4923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.1972 0.3627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.1972 3.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.7942 2.7927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.9500 3.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.9500 0.3280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
15.3990 2.8156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 12 1 0 0 0 0
1 17 1 0 0 0 0
2 16 1 0 0 0 0
2 18 1 0 0 0 0
3 6 1 0 0 0 0
3 7 1 0 0 0 0
3 10 1 0 0 0 0
3 30 1 0 0 0 0
4 8 1 0 0 0 0
4 9 1 0 0 0 0
4 39 1 0 0 0 0
4 40 1 0 0 0 0
5 28 2 0 0 0 0
5 29 1 0 0 0 0
6 8 1 0 0 0 0
6 31 1 0 0 0 0
6 32 1 0 0 0 0
7 9 1 0 0 0 0
7 33 1 0 0 0 0
7 34 1 0 0 0 0
8 35 1 0 0 0 0
8 36 1 0 0 0 0
9 37 1 0 0 0 0
9 38 1 0 0 0 0
10 11 1 0 0 0 0
10 41 1 0 0 0 0
10 42 1 0 0 0 0
11 12 2 0 0 0 0
11 13 1 0 0 0 0
12 14 1 0 0 0 0
13 15 2 0 0 0 0
13 43 1 0 0 0 0
14 16 2 0 0 0 0
14 44 1 0 0 0 0
15 16 1 0 0 0 0
15 45 1 0 0 0 0
17 46 1 0 0 0 0
17 47 1 0 0 0 0
17 48 1 0 0 0 0
18 19 1 0 0 0 0
18 49 1 0 0 0 0
18 50 1 0 0 0 0
19 26 3 0 0 0 0
20 21 2 0 0 0 0
20 23 1 0 0 0 0
20 28 1 0 0 0 0
21 24 1 0 0 0 0
21 27 1 0 0 0 0
22 23 2 0 0 0 0
22 25 1 0 0 0 0
22 26 1 0 0 0 0
23 51 1 0 0 0 0
24 25 2 0 0 0 0
24 52 1 0 0 0 0
25 53 1 0 0 0 0
27 29 2 0 0 0 0
27 54 1 0 0 0 0
28 55 1 0 0 0 0
29 56 1 0 0 0 0
M CHG 2 3 1 4 1
M END
$$$$