D0M9JF
-OEChem-10101305022D
45 48 0 0 0 0 0 0 0999 V2000
5.9433 7.5017 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0
3.5700 9.5538 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0
7.6530 3.4440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1871 0.3632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.9584 1.4282 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
4.1992 4.4324 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
1.4061 1.8767 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.0812 1.8909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8041 1.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0652 2.9324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9312 3.4324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4858 0.5786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4863 0.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7907 2.9376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1992 3.4324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1832 1.3631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2892 2.9256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2811 1.8840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9312 4.4324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0652 4.9324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3457 1.3342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3623 3.4896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8412 4.9392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0491 5.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4144 2.9617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8492 5.9808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9472 6.5017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5381 1.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0288 1.3682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4127 2.0644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9397 0.8392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1936 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0329 0.2539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9591 0.2515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8128 0.0518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0126 0.9056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3481 0.7142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3743 4.1095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3745 4.6231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5086 6.2777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8811 3.2779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3874 6.2888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2302 1.9182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 1.0722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8461 0.8419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 27 1 0 0 0 0
3 14 2 0 0 0 0
4 16 2 0 0 0 0
5 8 1 0 0 0 0
5 9 1 0 0 0 0
5 12 1 0 0 0 0
5 13 1 0 0 0 0
6 15 1 0 0 0 0
6 20 2 0 0 0 0
7 21 1 0 0 0 0
7 25 1 0 0 0 0
7 28 1 0 0 0 0
8 10 2 0 0 0 0
8 16 1 0 0 0 0
9 14 1 0 0 0 0
9 29 1 0 0 0 0
9 30 1 0 0 0 0
10 11 1 0 0 0 0
10 15 1 0 0 0 0
11 14 1 0 0 0 0
11 19 2 0 0 0 0
12 34 1 0 0 0 0
12 35 1 0 0 0 0
12 36 1 0 0 0 0
13 31 1 0 0 0 0
13 32 1 0 0 0 0
13 33 1 0 0 0 0
15 17 2 0 0 0 0
16 18 1 0 0 0 0
17 18 1 0 0 0 0
17 22 1 0 0 0 0
18 21 2 0 0 0 0
19 20 1 0 0 0 0
19 23 1 0 0 0 0
20 24 1 0 0 0 0
21 37 1 0 0 0 0
22 25 2 0 0 0 0
22 38 1 0 0 0 0
23 26 2 0 0 0 0
23 39 1 0 0 0 0
24 27 2 0 0 0 0
24 40 1 0 0 0 0
25 41 1 0 0 0 0
26 27 1 0 0 0 0
26 42 1 0 0 0 0
28 43 1 0 0 0 0
28 44 1 0 0 0 0
28 45 1 0 0 0 0
M CHG 2 2 -1 5 1
M END
$$$$