D00CJJ
-OEChem-10101305022D
31 33 0 0 0 0 0 0 0999 V2000
6.2619 1.2515 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 0.4468 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 2.0562 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.2515 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.7515 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 3.2515 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 -0.5037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9674 -0.7100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.7515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2781 -1.6605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.7515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2619 1.2515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.2515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2566 -1.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6103 -2.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5673 -2.8172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9209 -3.3553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.7515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8994 -3.5615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3751 -0.5911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9684 -1.1234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5812 -0.6226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9880 -0.0903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6707 -1.4052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0036 -2.2769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1739 -2.9451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5069 -3.8168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 0.4415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0920 -4.1508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 3.5615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 3.5615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 12 1 0 0 0 0
2 7 1 0 0 0 0
2 9 1 0 0 0 0
2 12 1 0 0 0 0
3 11 1 0 0 0 0
3 12 2 0 0 0 0
4 9 2 0 0 0 0
4 18 1 0 0 0 0
5 13 1 0 0 0 0
5 18 2 0 0 0 0
6 13 1 0 0 0 0
6 30 1 0 0 0 0
6 31 1 0 0 0 0
7 8 1 0 0 0 0
7 20 1 0 0 0 0
7 21 1 0 0 0 0
8 10 1 0 0 0 0
8 22 1 0 0 0 0
8 23 1 0 0 0 0
9 11 1 0 0 0 0
10 14 2 0 0 0 0
10 15 1 0 0 0 0
11 13 2 0 0 0 0
14 16 1 0 0 0 0
14 24 1 0 0 0 0
15 17 2 0 0 0 0
15 25 1 0 0 0 0
16 19 2 0 0 0 0
16 26 1 0 0 0 0
17 19 1 0 0 0 0
17 27 1 0 0 0 0
18 28 1 0 0 0 0
19 29 1 0 0 0 0
M END
$$$$