B2TON8
-OEChem-04022107542D
54 55 0 1 0 0 0 0 0999 V2000
2.0000 0.9050 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 3.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 1.9050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6603 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5263 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.0950 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
3.7320 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.3923 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.1928 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3957 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.2617 1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.0588 1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5297 1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3267 1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.9248 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.1278 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4607 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6636 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.0823 1.3681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.9292 1.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.7023 2.4419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 1.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -0.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -0.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 0.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5560 -2.0581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1760 -3.1319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 2.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 3.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 3.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 4.5250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -3.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 19 1 0 0 0 0
2 21 1 0 0 0 0
2 23 1 0 0 0 0
3 25 1 0 0 0 0
3 54 1 0 0 0 0
4 23 2 0 0 0 0
5 25 2 0 0 0 0
6 11 1 0 0 0 0
6 23 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 29 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 14 1 0 0 0 0
10 35 1 0 0 0 0
10 36 1 0 0 0 0
11 37 1 0 0 0 0
11 38 1 0 0 0 0
12 13 1 0 0 0 0
12 22 1 0 0 0 0
12 25 1 0 0 0 0
12 39 1 0 0 0 0
13 17 2 0 0 0 0
13 18 1 0 0 0 0
14 40 1 0 0 0 0
14 41 1 0 0 0 0
14 42 1 0 0 0 0
15 16 1 0 0 0 0
15 19 2 0 0 0 0
15 20 1 0 0 0 0
16 21 1 0 0 0 0
16 24 2 0 0 0 0
17 19 1 0 0 0 0
17 44 1 0 0 0 0
18 20 2 0 0 0 0
18 45 1 0 0 0 0
20 46 1 0 0 0 0
21 26 2 0 0 0 0
22 47 1 0 0 0 0
22 48 1 0 0 0 0
22 49 1 0 0 0 0
24 27 1 0 0 0 0
24 50 1 0 0 0 0
26 28 1 0 0 0 0
26 51 1 0 0 0 0
27 28 2 0 0 0 0
27 52 1 0 0 0 0
28 53 1 0 0 0 0
M END
$$$$