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TEST_1
-ISIS- 2D
Used JOELib chemistry kernel (expert systems) ID is 715333816
13 13 0 0 0 0 0 0 0 0 1 V2000
3.9852 0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1152 0.7487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2552 0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2552 -0.7513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3884 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5199 -0.7474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3864 -2.2448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1152 -1.2513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9852 -0.7513 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.8507 0.7496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8503 1.7444 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.9805 2.2448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.7205 0.2492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 4 0 0 0 0
9 1 4 0 0 0 0
1 10 1 0 0 0 0
2 3 4 0 0 0 0
3 4 4 0 0 0 0
4 5 1 0 0 0 0
4 8 4 0 0 0 0
5 6 1 0 0 0 0
5 7 2 0 0 0 0
8 9 4 0 0 0 0
10 11 1 0 0 0 0
10 13 2 0 0 0 0
11 12 1 0 0 0 0
M END
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