BXVR43
-OEChem-04022100272D
37 39 0 0 0 0 0 0 0999 V2000
4.0170 -0.5953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.8830 -2.0953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.9970 2.6358 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.8830 -0.0953 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.3830 3.0953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3830 3.0953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7595 2.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9820 1.3386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0065 2.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7840 1.3385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8830 0.9047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7690 2.6358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2295 0.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5365 0.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2318 0.9177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5342 0.9177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7660 1.9332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0169 -1.5953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1509 -2.0953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1509 -3.0953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5210 3.6998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8244 3.3643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9416 3.3643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2450 3.6998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6380 3.2418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3744 0.0156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3916 0.0155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4083 2.1183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7789 0.4943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9871 0.4942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3578 2.1182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9389 -1.5127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5403 -2.2030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5309 -3.0953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1509 -3.7153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7709 -3.0953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 4 1 0 0 0 0
1 19 1 0 0 0 0
2 19 2 0 0 0 0
3 9 1 0 0 0 0
3 18 2 0 0 0 0
4 11 2 0 0 0 0
5 6 1 0 0 0 0
5 7 1 0 0 0 0
5 22 1 0 0 0 0
5 23 1 0 0 0 0
6 9 1 0 0 0 0
6 24 1 0 0 0 0
6 25 1 0 0 0 0
7 8 1 0 0 0 0
7 12 2 0 0 0 0
8 11 1 0 0 0 0
8 13 2 0 0 0 0
9 10 2 0 0 0 0
10 11 1 0 0 0 0
10 14 1 0 0 0 0
12 15 1 0 0 0 0
12 26 1 0 0 0 0
13 16 1 0 0 0 0
13 27 1 0 0 0 0
14 17 2 0 0 0 0
14 28 1 0 0 0 0
15 16 2 0 0 0 0
15 29 1 0 0 0 0
16 30 1 0 0 0 0
17 18 1 0 0 0 0
17 31 1 0 0 0 0
18 32 1 0 0 0 0
19 20 1 0 0 0 0
20 21 1 0 0 0 0
20 33 1 0 0 0 0
20 34 1 0 0 0 0
21 35 1 0 0 0 0
21 36 1 0 0 0 0
21 37 1 0 0 0 0
M END
$$$$