BODJ51
-OEChem-04022102332D
50 52 0 0 0 0 0 0 0999 V2000
8.5991 -1.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -4.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 -3.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 4.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 4.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -0.5600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -1.5600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 -0.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 3.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -5.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 -4.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -3.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6720 2.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6910 0.4031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5380 0.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3110 1.4769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1551 -2.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0021 -2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.7751 -1.5231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6910 -4.5231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -5.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3110 -5.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9791 -4.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 -5.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2191 -4.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 5.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 19 1 0 0 0 0
1 27 1 0 0 0 0
2 20 1 0 0 0 0
2 28 1 0 0 0 0
3 21 1 0 0 0 0
3 29 1 0 0 0 0
4 26 1 0 0 0 0
4 50 1 0 0 0 0
5 26 2 0 0 0 0
6 10 2 0 0 0 0
6 13 1 0 0 0 0
7 18 2 0 0 0 0
7 25 1 0 0 0 0
8 18 1 0 0 0 0
8 39 1 0 0 0 0
8 40 1 0 0 0 0
9 10 1 0 0 0 0
9 11 2 0 0 0 0
9 14 1 0 0 0 0
10 18 1 0 0 0 0
11 17 1 0 0 0 0
11 24 1 0 0 0 0
12 13 1 0 0 0 0
12 15 2 0 0 0 0
12 16 1 0 0 0 0
13 25 2 0 0 0 0
14 23 2 0 0 0 0
14 30 1 0 0 0 0
15 20 1 0 0 0 0
15 31 1 0 0 0 0
16 19 2 0 0 0 0
16 32 1 0 0 0 0
17 22 2 0 0 0 0
17 33 1 0 0 0 0
19 21 1 0 0 0 0
20 21 2 0 0 0 0
22 23 1 0 0 0 0
22 26 1 0 0 0 0
23 34 1 0 0 0 0
24 35 1 0 0 0 0
24 36 1 0 0 0 0
24 37 1 0 0 0 0
25 38 1 0 0 0 0
27 41 1 0 0 0 0
27 42 1 0 0 0 0
27 43 1 0 0 0 0
28 44 1 0 0 0 0
28 45 1 0 0 0 0
28 46 1 0 0 0 0
29 47 1 0 0 0 0
29 48 1 0 0 0 0
29 49 1 0 0 0 0
M END
$$$$