BJCA29
-OEChem-04012117022D
42 40 0 1 0 0 0 0 0999 V2000
7.4871 2.8700 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
7.4871 5.3700 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
0.5369 2.6200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1350 4.1200 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
4.0010 0.6200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.1350 5.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0010 5.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0010 6.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2690 3.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8671 7.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2690 2.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0010 3.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8671 8.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4030 2.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1350 2.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1350 1.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4030 1.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2690 0.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9230 5.7026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5244 5.0123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2131 5.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6116 5.7277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7890 7.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3905 6.5123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0569 4.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6584 3.5123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0791 6.5374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4776 7.2277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6910 3.0831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5380 3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3110 4.1569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4871 8.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8671 8.7400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2471 8.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6720 2.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8660 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2690 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0010 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5380 0.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4871 2.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4871 5.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 41 1 0 0 0 0
2 42 1 0 0 0 0
3 14 1 0 0 0 0
3 38 1 0 0 0 0
4 6 1 0 0 0 0
4 9 1 0 0 0 0
4 12 1 0 0 0 0
5 16 1 0 0 0 0
5 39 1 0 0 0 0
5 40 1 0 0 0 0
6 7 1 0 0 0 0
6 19 1 0 0 0 0
6 20 1 0 0 0 0
7 8 1 0 0 0 0
7 21 1 0 0 0 0
7 22 1 0 0 0 0
8 10 1 0 0 0 0
8 23 1 0 0 0 0
8 24 1 0 0 0 0
9 11 1 0 0 0 0
9 25 1 0 0 0 0
9 26 1 0 0 0 0
10 13 1 0 0 0 0
10 27 1 0 0 0 0
10 28 1 0 0 0 0
11 14 2 0 0 0 0
11 15 1 0 0 0 0
12 29 1 0 0 0 0
12 30 1 0 0 0 0
12 31 1 0 0 0 0
13 32 1 0 0 0 0
13 33 1 0 0 0 0
13 34 1 0 0 0 0
14 17 1 0 0 0 0
15 16 2 0 0 0 0
15 35 1 0 0 0 0
16 18 1 0 0 0 0
17 18 2 0 0 0 0
17 36 1 0 0 0 0
18 37 1 0 0 0 0
M END
$$$$