BF0U8W
-OEChem-04012119212D
43 45 0 0 0 0 0 0 0999 V2000
6.2619 1.1075 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
8.2619 2.8395 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
8.7619 3.7056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.1279 2.3395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.3958 3.3395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 0.3027 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 1.9122 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.1075 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.6075 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 3.1075 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 -0.6478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9674 -0.8540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.6075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2619 1.1075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.6075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2781 -1.8045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7619 1.9735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7619 1.9735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.1075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6103 -2.5488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2566 -2.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.6075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9209 -3.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5673 -2.9612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8994 -3.7056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3751 -0.7351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9684 -1.2674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5812 -0.7666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9880 -0.2343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8695 2.5841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1793 2.1856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6542 1.3629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3445 1.7614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0036 -2.4210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6707 -1.5493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 0.2975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5069 -3.9608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1739 -3.0891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0920 -4.2949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 3.4175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 3.4175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3819 3.7056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1279 1.7195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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24 25 1 0 0 0 0
24 38 1 0 0 0 0
25 39 1 0 0 0 0
M END
$$$$