D04MMJ
-OEChem-10101305032D
51 54 0 1 0 0 0 0 0999 V2000
4.0463 0.0000 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0
1.0547 4.1843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.7250 7.4595 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
5.0890 4.2841 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3485 6.6776 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
6.1259 5.7027 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
7.8762 5.2819 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
7.3390 7.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
6.8785 4.9826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1080 6.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4292 6.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2250 5.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7250 7.4595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5502 7.9774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3240 5.7027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1015 6.6776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6389 4.9824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5023 8.2832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1107 4.1074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6045 5.0285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5808 3.2179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0541 4.1514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5456 3.2400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5264 3.3352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9760 6.1043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9928 4.8632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4971 4.7014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1488 7.2584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3795 4.6146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1557 4.4280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6799 6.0580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4417 6.8199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0472 7.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4870 7.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8630 8.0639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1664 7.7285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4660 8.5917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9307 8.0012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7149 7.1624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5429 6.4086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5364 3.8549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6919 7.6929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0926 8.4728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3127 8.8735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3165 5.5775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8814 2.6756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2222 2.7110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 3.6627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1989 2.8087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0529 3.0077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0463 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 51 1 0 0 0 0
2 22 1 0 0 0 0
2 24 1 0 0 0 0
3 5 1 0 0 0 0
3 11 1 0 0 0 0
3 13 1 0 0 0 0
4 12 1 0 0 0 0
4 19 1 0 0 0 0
4 41 1 0 0 0 0
5 6 1 0 0 0 0
5 8 1 0 0 0 0
5 25 1 0 0 0 0
6 9 1 0 0 0 0
6 12 1 0 0 0 0
6 26 1 0 0 0 0
7 9 1 0 0 0 0
7 10 1 0 0 0 0
7 11 1 0 0 0 0
7 27 1 0 0 0 0
8 10 1 0 0 0 0
8 14 1 0 0 0 0
8 28 1 0 0 0 0
9 29 1 0 0 0 0
9 30 1 0 0 0 0
10 31 1 0 0 0 0
10 32 1 0 0 0 0
11 33 1 0 0 0 0
11 34 1 0 0 0 0
12 15 2 0 0 0 0
13 16 1 0 0 0 0
13 35 1 0 0 0 0
13 36 1 0 0 0 0
14 18 1 0 0 0 0
14 37 1 0 0 0 0
14 38 1 0 0 0 0
15 16 1 0 0 0 0
15 17 1 0 0 0 0
16 39 1 0 0 0 0
16 40 1 0 0 0 0
17 19 2 0 0 0 0
17 20 1 0 0 0 0
18 42 1 0 0 0 0
18 43 1 0 0 0 0
18 44 1 0 0 0 0
19 21 1 0 0 0 0
20 22 2 0 0 0 0
20 45 1 0 0 0 0
21 23 2 0 0 0 0
21 46 1 0 0 0 0
22 23 1 0 0 0 0
23 47 1 0 0 0 0
24 48 1 0 0 0 0
24 49 1 0 0 0 0
24 50 1 0 0 0 0
M END
$$$$