B26LDF
-OEChem-04042103123D
38 40 0 1 0 0 0 0 0999 V2000
-2.3208 -2.2732 -1.6889 S 0 0 0 0 0 0 0 0 0 0 0 0
5.4916 0.7158 -0.2782 S 0 0 0 0 0 0 0 0 0 0 0 0
-6.0584 2.5216 0.5364 F 0 0 0 0 0 0 0 0 0 0 0 0
-0.2178 -2.9289 1.4921 O 0 0 0 0 0 0 0 0 0 0 0 0
6.1579 1.1150 0.9535 O 0 0 0 0 0 0 0 0 0 0 0 0
5.9932 -0.4224 -1.0355 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9332 -1.1372 0.1860 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.2459 -0.1980 0.9067 N 0 0 0 0 0 0 0 0 0 0 0 0
5.3987 2.0684 -1.3181 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.7196 -0.7243 -0.9492 C 0 0 2 0 0 0 0 0 0 0 0 0
-2.8697 0.1362 -0.5552 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7174 -3.3222 -0.3424 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8623 -2.4633 0.5576 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1027 0.0177 0.6287 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3481 1.1067 -1.4356 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4685 -0.0283 0.6938 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8570 0.8633 1.4422 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6982 -0.6131 -0.4636 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8020 0.4475 0.0709 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2066 1.0782 1.1634 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0479 -0.3982 -0.7425 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4251 1.9128 -1.0669 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5455 0.7778 1.0626 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0237 1.7482 0.1822 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0632 -0.2134 -1.6622 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5606 -3.7190 0.2287 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1191 -4.1417 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6887 0.1989 1.7246 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8911 1.2447 -2.4119 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1388 -0.7849 1.3999 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4039 1.3616 2.2955 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1565 -1.2763 -1.1309 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7733 1.7458 1.8064 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4898 -0.8938 -1.6024 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7979 2.6683 -1.7521 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0150 0.6474 2.0331 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7232 2.9726 -0.9543 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6096 1.9205 -2.3126 H 0 0 0 0 0 0 0 0 0 0 0 0
1 10 1 0 0 0 0
1 12 1 0 0 0 0
2 5 2 0 0 0 0
2 6 2 0 0 0 0
2 9 1 0 0 0 0
2 19 1 0 0 0 0
3 24 1 0 0 0 0
4 13 2 0 0 0 0
7 8 1 0 0 0 0
7 10 1 0 0 0 0
7 13 1 0 0 0 0
8 14 1 0 0 0 0
8 28 1 0 0 0 0
9 37 1 0 0 0 0
9 38 1 0 0 0 0
10 11 1 0 0 0 0
10 25 1 0 0 0 0
11 15 2 0 0 0 0
11 16 1 0 0 0 0
12 13 1 0 0 0 0
12 26 1 0 0 0 0
12 27 1 0 0 0 0
14 17 2 0 0 0 0
14 18 1 0 0 0 0
15 22 1 0 0 0 0
15 29 1 0 0 0 0
16 23 2 0 0 0 0
16 30 1 0 0 0 0
17 20 1 0 0 0 0
17 31 1 0 0 0 0
18 21 2 0 0 0 0
18 32 1 0 0 0 0
19 20 2 0 0 0 0
19 21 1 0 0 0 0
20 33 1 0 0 0 0
21 34 1 0 0 0 0
22 24 2 0 0 0 0
22 35 1 0 0 0 0
23 24 1 0 0 0 0
23 36 1 0 0 0 0
M END
$$$$