BDL6H9
-OEChem-04022101392D
62 67 0 1 0 0 0 0 0999 V2000
4.6783 0.1538 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
6.7619 0.0925 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
5.9352 3.0186 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
7.6279 0.5925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.8958 -0.4075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.2619 -5.9696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.2619 0.9586 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.4053 3.5186 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.4586 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
3.7320 0.4586 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
2.8660 1.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.0414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.4586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.4586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 1.7633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2619 0.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 2.7138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9394 4.0126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 4.3233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2619 -0.7735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6838 4.6805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7827 5.3018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7619 -1.6395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2619 -0.7735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4775 5.6590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5270 5.9696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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9.7619 -3.3716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2619 -4.2376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.2619 -4.2376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7619 -5.1036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7619 -5.1036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.2619 -5.9696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7977 2.0751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7977 -0.1580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2646 2.4335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4675 2.4335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4675 -0.5164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2646 -0.5164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7880 2.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3894 1.3509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3894 0.5662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7880 -0.1240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5719 1.4955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2731 4.4879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1934 5.4944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1419 -1.6395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5719 -0.2365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9390 6.0730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3992 6.5763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9519 -3.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3819 -1.6395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0719 -2.8346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6419 -4.2376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.8819 -4.2376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4519 -5.6406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.2619 -6.5896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.8819 -5.9696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.2619 -5.3496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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36 60 1 0 0 0 0
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36 62 1 0 0 0 0
M END
$$$$