BN5T6S
-OEChem-04012118032D
34 36 0 0 0 0 0 0 0999 V2000
6.2619 2.0042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 3.7594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 1.1994 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.9674 0.0427 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 0.2489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 2.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2619 2.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 2.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 3.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2781 -0.9078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6103 -1.6521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2566 -1.1141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8994 -2.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9209 -2.6027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5673 -2.0646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2101 -3.7594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3751 0.1615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9684 -0.3708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3815 0.5041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.3842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 3.6242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 1.1942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 2.8142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0036 -1.5243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6707 -0.6526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5069 -3.0641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1739 -2.1924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6208 -3.9520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4027 -4.3487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7994 -3.5668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 8 2 0 0 0 0
2 9 2 0 0 0 0
3 5 1 0 0 0 0
3 6 1 0 0 0 0
3 8 1 0 0 0 0
4 6 1 0 0 0 0
4 12 1 0 0 0 0
4 23 1 0 0 0 0
5 7 1 0 0 0 0
5 10 2 0 0 0 0
6 21 1 0 0 0 0
6 22 1 0 0 0 0
7 9 1 0 0 0 0
7 11 2 0 0 0 0
8 9 1 0 0 0 0
10 13 1 0 0 0 0
10 24 1 0 0 0 0
11 14 1 0 0 0 0
11 25 1 0 0 0 0
12 15 2 0 0 0 0
12 16 1 0 0 0 0
13 14 2 0 0 0 0
13 26 1 0 0 0 0
14 27 1 0 0 0 0
15 18 1 0 0 0 0
15 28 1 0 0 0 0
16 19 2 0 0 0 0
16 29 1 0 0 0 0
17 18 2 0 0 0 0
17 19 1 0 0 0 0
17 20 1 0 0 0 0
18 30 1 0 0 0 0
19 31 1 0 0 0 0
20 32 1 0 0 0 0
20 33 1 0 0 0 0
20 34 1 0 0 0 0
M END
$$$$