D0U3YC
-OEChem-10101305022D
36 37 0 0 0 0 0 0 0999 V2000
2.0000 -3.1555 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0
3.8744 3.1992 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.3445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5686 2.8391 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.3445 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.0334 4.4863 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3776 1.4378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.5468 3.0470 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.0468 2.1809 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -4.1555 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -4.6555 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
5.4641 -5.1555 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0
4.5981 1.3445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.8445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8255 3.5082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.6555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.6555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2902 5.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9844 4.7954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.6555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.6555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3860 1.9271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9875 1.2369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 0.0345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -1.3455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -1.3455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1760 4.2057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5741 4.9869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7051 5.6162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8295 5.5703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8754 4.6947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7929 5.3850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -2.9655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 22 1 0 0 0 0
2 15 2 0 0 0 0
3 17 2 0 0 0 0
4 8 1 0 0 0 0
4 14 1 0 0 0 0
4 15 1 0 0 0 0
5 13 1 0 0 0 0
5 17 1 0 0 0 0
5 27 1 0 0 0 0
6 15 1 0 0 0 0
6 20 1 0 0 0 0
6 21 1 0 0 0 0
7 9 1 0 0 0 0
7 14 2 0 0 0 0
8 9 2 0 0 0 0
10 11 2 0 0 0 0
10 24 1 0 0 0 0
11 12 2 0 0 0 0
13 14 1 0 0 0 0
13 25 1 0 0 0 0
13 26 1 0 0 0 0
16 17 1 0 0 0 0
16 18 2 0 0 0 0
16 19 1 0 0 0 0
18 22 1 0 0 0 0
18 28 1 0 0 0 0
19 23 2 0 0 0 0
19 29 1 0 0 0 0
20 32 1 0 0 0 0
20 33 1 0 0 0 0
20 34 1 0 0 0 0
21 30 1 0 0 0 0
21 31 1 0 0 0 0
21 35 1 0 0 0 0
22 24 2 0 0 0 0
23 24 1 0 0 0 0
23 36 1 0 0 0 0
M CHG 2 11 1 12 -1
M END
$$$$