BGJ2B9
-OEChem-04022107532D
55 57 0 1 0 0 0 0 0999 V2000
2.0000 -1.3450 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 3.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -5.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -4.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 3.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 4.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 4.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 5.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 4.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 6.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 5.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 4.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -4.3450 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
3.7320 -3.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -4.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -4.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6592 4.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6636 3.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4607 3.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9841 6.2376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5856 5.5473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1403 4.0724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5388 4.7627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4607 6.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6636 6.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5388 5.5473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1403 6.2376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1181 4.7376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7196 4.0473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 2.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -4.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -3.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -3.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -1.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 2.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5560 -4.3081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -5.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1760 -5.3819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -6.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 23 1 0 0 0 0
2 14 1 0 0 0 0
2 15 1 0 0 0 0
3 14 2 0 0 0 0
4 29 1 0 0 0 0
4 55 1 0 0 0 0
5 29 2 0 0 0 0
6 13 1 0 0 0 0
6 14 1 0 0 0 0
6 43 1 0 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 13 1 0 0 0 0
7 30 1 0 0 0 0
8 10 1 0 0 0 0
8 31 1 0 0 0 0
8 32 1 0 0 0 0
9 11 1 0 0 0 0
9 33 1 0 0 0 0
9 34 1 0 0 0 0
10 12 1 0 0 0 0
10 35 1 0 0 0 0
10 36 1 0 0 0 0
11 12 1 0 0 0 0
11 37 1 0 0 0 0
11 38 1 0 0 0 0
12 39 1 0 0 0 0
12 40 1 0 0 0 0
13 41 1 0 0 0 0
13 42 1 0 0 0 0
15 20 1 0 0 0 0
15 25 2 0 0 0 0
16 17 1 0 0 0 0
16 26 1 0 0 0 0
16 29 1 0 0 0 0
16 44 1 0 0 0 0
17 21 2 0 0 0 0
17 22 1 0 0 0 0
18 19 1 0 0 0 0
18 23 2 0 0 0 0
18 24 1 0 0 0 0
19 20 2 0 0 0 0
19 27 1 0 0 0 0
20 45 1 0 0 0 0
21 23 1 0 0 0 0
21 46 1 0 0 0 0
22 24 2 0 0 0 0
22 47 1 0 0 0 0
24 48 1 0 0 0 0
25 28 1 0 0 0 0
25 49 1 0 0 0 0
26 50 1 0 0 0 0
26 51 1 0 0 0 0
26 52 1 0 0 0 0
27 28 2 0 0 0 0
27 53 1 0 0 0 0
28 54 1 0 0 0 0
M END
$$$$