BVQI86
-OEChem-04012115072D
51 52 0 1 0 0 0 0 0999 V2000
6.3200 9.7983 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 4.6492 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0
6.1920 7.1247 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
4.4030 2.0369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.1350 1.0369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.0010 5.5369 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.8100 7.1247 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.5010 8.0758 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
6.1350 5.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0010 6.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8671 5.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5010 8.0758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1350 4.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7331 5.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9132 8.8848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2690 3.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0010 3.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5991 5.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7331 6.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2690 2.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0010 2.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1350 2.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.4651 5.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5991 7.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.4651 6.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5369 2.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0010 0.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8887 7.9788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9230 5.6195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5244 4.9293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4685 4.5620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2656 4.5620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1075 8.2047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4362 8.6924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3992 9.2315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4826 8.4388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7320 3.8469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5380 3.8469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5991 4.4169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1962 6.8469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5380 2.2269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.0021 5.2269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5991 7.6569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.0021 6.8469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8469 3.0739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 2.8469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2269 2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6910 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5380 0.2269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3110 1.0739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0000 4.6492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 15 1 0 0 0 0
2 51 1 0 0 0 0
3 8 1 0 0 0 0
3 10 1 0 0 0 0
4 20 1 0 0 0 0
4 26 1 0 0 0 0
5 22 1 0 0 0 0
5 27 1 0 0 0 0
6 9 1 0 0 0 0
6 10 1 0 0 0 0
6 11 1 0 0 0 0
7 10 2 0 0 0 0
7 12 1 0 0 0 0
8 12 1 0 0 0 0
8 15 1 0 0 0 0
8 28 1 0 0 0 0
9 13 1 0 0 0 0
9 29 1 0 0 0 0
9 30 1 0 0 0 0
11 14 1 0 0 0 0
11 31 1 0 0 0 0
11 32 1 0 0 0 0
12 33 1 0 0 0 0
12 34 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
15 35 1 0 0 0 0
15 36 1 0 0 0 0
16 20 1 0 0 0 0
16 37 1 0 0 0 0
17 21 2 0 0 0 0
17 38 1 0 0 0 0
18 23 1 0 0 0 0
18 39 1 0 0 0 0
19 24 2 0 0 0 0
19 40 1 0 0 0 0
20 22 2 0 0 0 0
21 22 1 0 0 0 0
21 41 1 0 0 0 0
23 25 2 0 0 0 0
23 42 1 0 0 0 0
24 25 1 0 0 0 0
24 43 1 0 0 0 0
25 44 1 0 0 0 0
26 45 1 0 0 0 0
26 46 1 0 0 0 0
26 47 1 0 0 0 0
27 48 1 0 0 0 0
27 49 1 0 0 0 0
27 50 1 0 0 0 0
M END
$$$$