BSQ50Y
-OEChem-04012119342D
52 55 0 1 0 0 0 0 0999 V2000
3.8000 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 -2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 2.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.6660 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8000 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8000 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9061 -0.4653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9061 -2.5347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0690 1.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0555 2.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4540 1.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0690 0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2860 3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0460 3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 1.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8612 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9132 0.1546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9132 -3.1546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6671 2.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4643 -0.6671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9350 -0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4643 -2.3329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6671 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8612 -3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 -1.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 -4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6671 -2.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6671 -3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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5 2 1 6 0 0 0
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29 52 1 0 0 0 0
M END
$$$$