BS5EH7
-OEChem-04012113282D
37 39 0 0 0 0 0 0 0999 V2000
4.0823 -3.6307 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
2.9945 2.7172 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
8.1537 2.4036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.7634 3.6307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.1646 2.6126 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5823 1.9081 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.8913 0.9571 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.2733 0.9571 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.5714 1.6991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7524 3.4216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5659 1.5946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7469 3.3171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1701 2.7172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5823 1.9081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0823 0.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0823 -0.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9483 -1.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2163 -1.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9483 -2.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2163 -2.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0823 -2.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.6126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9698 1.5491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6146 1.0806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9233 4.0176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1952 3.6934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3950 0.9986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1231 1.3228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3485 3.4671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7037 3.9356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4853 -0.8207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6794 -0.8207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4853 -2.4407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6794 -2.4407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9352 3.2292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3834 2.5478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0648 1.9960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 21 1 0 0 0 0
2 14 1 0 0 0 0
2 22 1 0 0 0 0
3 11 1 0 0 0 0
3 12 1 0 0 0 0
4 13 2 0 0 0 0
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7 15 2 0 0 0 0
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9 24 1 0 0 0 0
10 12 1 0 0 0 0
10 25 1 0 0 0 0
10 26 1 0 0 0 0
11 27 1 0 0 0 0
11 28 1 0 0 0 0
12 29 1 0 0 0 0
12 30 1 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
16 18 1 0 0 0 0
17 19 1 0 0 0 0
17 31 1 0 0 0 0
18 20 2 0 0 0 0
18 32 1 0 0 0 0
19 21 2 0 0 0 0
19 33 1 0 0 0 0
20 21 1 0 0 0 0
20 34 1 0 0 0 0
22 35 1 0 0 0 0
22 36 1 0 0 0 0
22 37 1 0 0 0 0
M END
$$$$