BR0DB3
-OEChem-04012112322D
37 38 0 0 0 0 0 0 0999 V2000
6.8671 -3.2500 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3346 0.7751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1316 0.7751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6550 3.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2565 2.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8112 1.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2097 1.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1316 3.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3346 3.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2097 2.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8112 3.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5380 -1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 18 1 0 0 0 0
2 13 2 0 0 0 0
3 20 1 0 0 0 0
3 37 1 0 0 0 0
4 20 2 0 0 0 0
5 7 1 0 0 0 0
5 13 1 0 0 0 0
5 32 1 0 0 0 0
6 13 1 0 0 0 0
6 14 1 0 0 0 0
6 33 1 0 0 0 0
7 8 1 0 0 0 0
7 9 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
9 24 1 0 0 0 0
9 25 1 0 0 0 0
10 12 1 0 0 0 0
10 26 1 0 0 0 0
10 27 1 0 0 0 0
11 12 1 0 0 0 0
11 28 1 0 0 0 0
11 29 1 0 0 0 0
12 30 1 0 0 0 0
12 31 1 0 0 0 0
14 15 2 0 0 0 0
14 16 1 0 0 0 0
15 17 1 0 0 0 0
15 20 1 0 0 0 0
16 18 2 0 0 0 0
16 34 1 0 0 0 0
17 19 2 0 0 0 0
17 35 1 0 0 0 0
18 19 1 0 0 0 0
19 36 1 0 0 0 0
M END
$$$$