B50ABY
-OEChem-04022101342D
48 49 0 1 0 0 0 0 0999 V2000
4.0678 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
8.4957 11.3239 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
9.1356 10.0627 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
7.2346 10.6840 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
3.4641 3.1181 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 5.1181 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 3.1181 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
3.4641 8.1181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1962 8.1181 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.9282 9.1181 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.8744 7.8134 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.4580 8.6181 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5981 6.6181 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.1962 9.1181 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.0622 9.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0622 7.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9282 8.1181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3301 7.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3301 9.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3301 6.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4641 6.1181 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
7.8744 9.4228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4641 5.1181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1851 10.3733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5981 4.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5981 3.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7320 5.1181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8660 4.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7320 3.1181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8660 3.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6592 8.8081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4607 10.0930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6636 10.0930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6636 7.1431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4607 7.1431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6401 10.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7932 9.9281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0201 9.0811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5422 6.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9407 6.7258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9272 5.8081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6762 4.5355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0747 5.2258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5981 7.2381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0611 6.3081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7320 5.7381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7320 2.4981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0678 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 48 1 0 0 0 0
2 24 1 0 0 0 0
3 24 1 0 0 0 0
4 24 1 0 0 0 0
5 26 1 0 0 0 0
6 28 1 0 0 0 0
7 30 1 0 0 0 0
8 18 2 0 0 0 0
9 14 1 0 0 0 0
9 16 1 0 0 0 0
9 18 1 0 0 0 0
10 15 1 0 0 0 0
10 17 1 0 0 0 0
10 22 1 0 0 0 0
11 12 1 0 0 0 0
11 17 2 0 0 0 0
12 22 2 0 0 0 0
21 13 1 1 0 0 0
13 44 1 0 0 0 0
13 45 1 0 0 0 0
14 15 1 0 0 0 0
14 19 1 6 0 0 0
14 31 1 0 0 0 0
15 32 1 0 0 0 0
15 33 1 0 0 0 0
16 17 1 0 0 0 0
16 34 1 0 0 0 0
16 35 1 0 0 0 0
18 20 1 0 0 0 0
19 36 1 0 0 0 0
19 37 1 0 0 0 0
19 38 1 0 0 0 0
20 21 1 0 0 0 0
20 39 1 0 0 0 0
20 40 1 0 0 0 0
21 23 1 0 0 0 0
21 41 1 0 0 0 0
22 24 1 0 0 0 0
23 25 1 0 0 0 0
23 42 1 0 0 0 0
23 43 1 0 0 0 0
25 26 1 0 0 0 0
25 27 2 0 0 0 0
26 29 2 0 0 0 0
27 28 1 0 0 0 0
27 46 1 0 0 0 0
28 30 2 0 0 0 0
29 30 1 0 0 0 0
29 47 1 0 0 0 0
M END
$$$$