B5BM6Q
-OEChem-04012116262D
48 51 0 0 0 0 0 0 0999 V2000
9.4651 -1.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.3312 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.1972 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.3312 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.1972 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -2.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1360 -2.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3312 -0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5380 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1360 -3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.7341 0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3312 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.7341 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 1.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6720 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 10 2 0 0 0 0
2 11 1 0 0 0 0
2 41 1 0 0 0 0
3 12 2 0 0 0 0
4 15 2 0 0 0 0
5 29 1 0 0 0 0
5 48 1 0 0 0 0
6 10 1 0 0 0 0
6 11 1 0 0 0 0
6 13 1 0 0 0 0
7 10 1 0 0 0 0
7 12 1 0 0 0 0
7 14 1 0 0 0 0
8 15 1 0 0 0 0
8 20 1 0 0 0 0
8 36 1 0 0 0 0
9 11 2 0 0 0 0
9 12 1 0 0 0 0
9 15 1 0 0 0 0
13 16 2 0 0 0 0
13 17 1 0 0 0 0
14 18 2 0 0 0 0
14 19 1 0 0 0 0
16 21 1 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
18 23 1 0 0 0 0
18 34 1 0 0 0 0
19 24 2 0 0 0 0
19 35 1 0 0 0 0
20 27 2 0 0 0 0
20 28 1 0 0 0 0
21 25 2 0 0 0 0
21 37 1 0 0 0 0
22 25 1 0 0 0 0
22 38 1 0 0 0 0
23 26 2 0 0 0 0
23 39 1 0 0 0 0
24 26 1 0 0 0 0
24 40 1 0 0 0 0
25 42 1 0 0 0 0
26 43 1 0 0 0 0
27 29 1 0 0 0 0
27 44 1 0 0 0 0
28 30 2 0 0 0 0
28 45 1 0 0 0 0
29 31 2 0 0 0 0
30 31 1 0 0 0 0
30 46 1 0 0 0 0
31 47 1 0 0 0 0
M END
$$$$