BQ65UJ
-OEChem-04012113312D
57 59 0 0 0 0 0 0 0999 V2000
6.7469 1.9604 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
8.5158 2.8739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.3347 1.1514 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.9170 1.8559 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.0257 0.2003 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.6437 0.2003 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.1701 2.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5823 3.3694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1646 2.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5878 3.2648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7524 1.8559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 4.0739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3347 1.1514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8347 -0.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9225 1.9604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8347 -1.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.5048 2.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7007 -1.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9687 -1.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8347 -3.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.3238 0.9423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7007 -2.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9687 -2.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.4993 2.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.0981 3.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8347 -4.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.0871 3.3694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6858 4.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.6804 4.2829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6128 2.2886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3410 1.9644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1396 3.6412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4114 3.9654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7219 2.9367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9937 3.2609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0305 2.9931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7587 2.6689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1952 1.5841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9233 1.2599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5016 4.4383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6356 4.5755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4984 3.7094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2377 -1.5774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4318 -1.5774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.7574 0.6902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.5759 0.3759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.8901 1.1945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2377 -3.1974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4318 -3.1974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.7515 1.9940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4815 3.6432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2147 -4.3874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8347 -5.0075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4547 -4.3874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.7037 3.3046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.4337 4.9538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.0448 4.7845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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5 13 2 0 0 0 0
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25 28 2 0 0 0 0
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27 29 2 0 0 0 0
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28 29 1 0 0 0 0
28 56 1 0 0 0 0
29 57 1 0 0 0 0
M END
$$$$