B2ETL9
-OEChem-04012116552D
48 51 0 1 0 0 0 0 0999 V2000
5.4641 -3.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 3.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 1.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.6550 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
5.4641 -0.6550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.8450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -2.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.2764 -2.4597 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.8450 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.7320 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2764 -0.8503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8600 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 1.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3426 0.2373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9441 0.9276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7880 0.9276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3894 0.2373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4675 -1.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2646 -1.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3894 -0.5473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7880 -1.2376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 2.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 2.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 -2.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2520 0.9276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8535 0.2373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4690 -0.2609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4800 -1.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7932 2.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -0.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 2.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 0.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 18 2 0 0 0 0
2 27 1 0 0 0 0
2 48 1 0 0 0 0
3 27 2 0 0 0 0
4 10 1 0 0 0 0
4 12 1 0 0 0 0
4 14 1 0 0 0 0
5 14 1 0 0 0 0
5 15 1 0 0 0 0
5 17 1 0 0 0 0
9 6 1 1 0 0 0
6 37 1 0 0 0 0
6 38 1 0 0 0 0
7 8 1 0 0 0 0
7 15 1 0 0 0 0
7 18 1 0 0 0 0
8 21 2 0 0 0 0
9 10 1 0 0 0 0
9 11 1 0 0 0 0
9 28 1 0 0 0 0
10 29 1 0 0 0 0
10 30 1 0 0 0 0
11 13 1 0 0 0 0
11 31 1 0 0 0 0
11 32 1 0 0 0 0
12 13 1 0 0 0 0
12 33 1 0 0 0 0
12 34 1 0 0 0 0
13 35 1 0 0 0 0
13 36 1 0 0 0 0
14 16 2 0 0 0 0
15 20 2 0 0 0 0
16 18 1 0 0 0 0
16 39 1 0 0 0 0
17 19 1 0 0 0 0
17 40 1 0 0 0 0
17 41 1 0 0 0 0
19 22 2 0 0 0 0
19 23 1 0 0 0 0
20 21 1 0 0 0 0
20 42 1 0 0 0 0
21 43 1 0 0 0 0
22 24 1 0 0 0 0
22 44 1 0 0 0 0
23 25 2 0 0 0 0
23 45 1 0 0 0 0
24 26 2 0 0 0 0
24 46 1 0 0 0 0
25 26 1 0 0 0 0
25 47 1 0 0 0 0
26 27 1 0 0 0 0
M END
$$$$