BS0K5C
-OEChem-04012114132D
48 48 0 1 0 0 0 0 0999 V2000
4.2690 -1.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -4.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 -3.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -3.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 -0.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 1.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -3.3450 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.4030 -2.8450 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.1350 -2.8450 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
3.4030 -1.8450 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.1350 -1.8450 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
2.5369 -1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -0.3450 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
5.1350 0.1550 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
6.8671 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.3312 3.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.1972 3.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.0632 4.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.9292 4.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -3.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -3.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9264 -1.2373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3249 -1.9276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5380 -0.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -4.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -3.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4040 -0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -0.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 0.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.2392 4.1181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.4662 4.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.6192 5.1919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 11 1 0 0 0 0
1 12 1 0 0 0 0
12 2 1 1 0 0 0
2 14 1 0 0 0 0
8 3 1 1 0 0 0
3 35 1 0 0 0 0
9 4 1 6 0 0 0
4 36 1 0 0 0 0
10 5 1 6 0 0 0
5 37 1 0 0 0 0
6 13 1 0 0 0 0
6 39 1 0 0 0 0
7 15 1 0 0 0 0
7 42 1 0 0 0 0
8 9 1 0 0 0 0
8 10 1 0 0 0 0
8 27 1 0 0 0 0
9 11 1 0 0 0 0
9 28 1 0 0 0 0
10 12 1 0 0 0 0
10 29 1 0 0 0 0
11 13 1 1 0 0 0
11 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
14 15 1 0 0 0 0
14 16 1 0 0 0 0
14 34 1 0 0 0 0
15 17 1 0 0 0 0
15 38 1 0 0 0 0
16 18 2 0 0 0 0
16 40 1 0 0 0 0
17 19 2 0 0 0 0
17 41 1 0 0 0 0
18 20 1 0 0 0 0
18 43 1 0 0 0 0
19 44 1 0 0 0 0
19 45 1 0 0 0 0
20 21 3 0 0 0 0
21 22 1 0 0 0 0
22 23 3 0 0 0 0
23 24 1 0 0 0 0
24 25 3 0 0 0 0
25 26 1 0 0 0 0
26 46 1 0 0 0 0
26 47 1 0 0 0 0
26 48 1 0 0 0 0
M END
$$$$