D01UXJ
-OEChem-10121501392D
43 44 0 0 0 0 0 0 0999 V2000
3.7320 -0.9297 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
4.7320 -0.9297 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7320 -0.9297 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.9954 4.0362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1819 5.8633 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.0703 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -5.4297 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5942 5.0543 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.9297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.9297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -4.9297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.4297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.4297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.4297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.4297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5411 0.6581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9230 0.6581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2320 1.6092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2320 1.6092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -6.4297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -4.9297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8198 2.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4131 3.3317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0009 4.1407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9441 -5.5123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3426 -4.8220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -2.1197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -2.1197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -3.7397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -3.7397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1307 0.4665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3334 0.4665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8676 2.1107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2460 -6.4297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -7.0497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4860 -6.4297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 -4.3928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -4.6197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 -5.4666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4364 2.3534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7965 3.3965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9775 5.1191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9298 6.4297 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 9 1 0 0 0 0
4 24 2 0 0 0 0
5 8 1 0 0 0 0
5 43 1 0 0 0 0
6 16 1 0 0 0 0
6 17 1 0 0 0 0
7 11 1 0 0 0 0
7 20 1 0 0 0 0
7 21 1 0 0 0 0
8 24 1 0 0 0 0
8 42 1 0 0 0 0
9 12 2 0 0 0 0
9 13 1 0 0 0 0
10 11 1 0 0 0 0
10 14 2 0 0 0 0
10 15 1 0 0 0 0
11 25 1 0 0 0 0
11 26 1 0 0 0 0
12 14 1 0 0 0 0
12 27 1 0 0 0 0
13 15 2 0 0 0 0
13 28 1 0 0 0 0
14 29 1 0 0 0 0
15 30 1 0 0 0 0
16 18 2 0 0 0 0
16 31 1 0 0 0 0
17 19 2 0 0 0 0
17 32 1 0 0 0 0
18 19 1 0 0 0 0
18 22 1 0 0 0 0
19 33 1 0 0 0 0
20 34 1 0 0 0 0
20 35 1 0 0 0 0
20 36 1 0 0 0 0
21 37 1 0 0 0 0
21 38 1 0 0 0 0
21 39 1 0 0 0 0
22 23 2 0 0 0 0
22 40 1 0 0 0 0
23 24 1 0 0 0 0
23 41 1 0 0 0 0
M END
$$$$