BMR54A
-OEChem-04012119282D
61 61 0 1 0 0 0 0 0999 V2000
6.3301 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 4.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 5.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.5981 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.4641 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 4.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
8.0622 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 2.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2181 3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9781 3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4220 2.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1951 1.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0420 1.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6401 -1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0201 0.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8441 -2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0841 -2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6592 4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7522 2.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 3.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3722 4.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6592 5.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -2.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3722 4.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 5.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7522 6.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -3.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -3.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -5.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -5.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -6.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 13 2 0 0 0 0
2 18 2 0 0 0 0
3 19 2 0 0 0 0
11 4 1 1 0 0 0
4 13 1 0 0 0 0
4 33 1 0 0 0 0
9 5 1 6 0 0 0
5 19 1 0 0 0 0
5 34 1 0 0 0 0
6 8 1 0 0 0 0
6 18 1 0 0 0 0
6 48 1 0 0 0 0
20 7 1 1 0 0 0
7 22 1 0 0 0 0
7 52 1 0 0 0 0
8 23 1 0 0 0 0
8 53 1 0 0 0 0
9 10 1 0 0 0 0
9 13 1 0 0 0 0
9 29 1 0 0 0 0
10 14 1 0 0 0 0
10 15 1 0 0 0 0
10 30 1 0 0 0 0
11 12 1 0 0 0 0
11 18 1 0 0 0 0
11 31 1 0 0 0 0
12 16 1 0 0 0 0
12 17 1 0 0 0 0
12 32 1 0 0 0 0
14 35 1 0 0 0 0
14 36 1 0 0 0 0
14 37 1 0 0 0 0
15 38 1 0 0 0 0
15 39 1 0 0 0 0
15 40 1 0 0 0 0
16 41 1 0 0 0 0
16 42 1 0 0 0 0
16 43 1 0 0 0 0
17 44 1 0 0 0 0
17 45 1 0 0 0 0
17 46 1 0 0 0 0
19 20 1 0 0 0 0
20 21 1 0 0 0 0
20 47 1 0 0 0 0
21 49 1 0 0 0 0
21 50 1 0 0 0 0
21 51 1 0 0 0 0
22 54 1 0 0 0 0
22 55 1 0 0 0 0
22 56 1 0 0 0 0
23 24 2 0 0 0 0
23 25 1 0 0 0 0
24 26 1 0 0 0 0
24 57 1 0 0 0 0
25 27 2 0 0 0 0
25 58 1 0 0 0 0
26 28 2 0 0 0 0
26 59 1 0 0 0 0
27 28 1 0 0 0 0
27 60 1 0 0 0 0
28 61 1 0 0 0 0
M END
$$$$