B1BCO8
-OEChem-04012112583D
38 40 0 0 0 0 0 0 0999 V2000
4.2477 0.0808 -0.1423 S 0 0 0 0 0 0 0 0 0 0 0 0
-2.4713 4.3699 -0.1533 F 0 0 0 0 0 0 0 0 0 0 0 0
4.9148 -0.2550 1.1091 O 0 0 0 0 0 0 0 0 0 0 0 0
4.8362 -0.3522 -1.4026 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3046 -1.9590 0.0526 N 0 0 0 0 0 0 0 0 0 0 0 0
4.0170 1.7733 -0.2010 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.4479 -1.1981 0.0494 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0065 -1.4773 0.0065 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6095 -0.5206 -0.0848 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4541 0.2435 -0.0038 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6332 -3.2884 0.1091 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6208 -1.2870 -1.2227 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6725 -1.1970 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5224 -2.0633 0.1044 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9294 -0.8062 -1.2687 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9810 -0.7160 1.1451 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0070 -3.3825 0.1418 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4313 0.9843 1.1777 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4826 0.8965 -1.2361 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4372 2.3782 1.1272 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4885 2.2905 -1.2868 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4657 3.0314 -0.1051 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3102 2.4543 0.8933 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8730 -4.0590 0.1213 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1007 -1.5039 -2.1523 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1932 -1.3438 2.1554 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5659 -1.7785 0.1163 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3960 -0.6548 -2.2379 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4900 -0.4967 2.0794 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5744 -4.3014 0.1879 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4082 0.4908 2.1464 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5000 0.3337 -2.1664 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9621 2.2272 -1.1211 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4191 2.9553 2.0469 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5103 2.7994 -2.2459 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2333 2.4457 0.7072 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6447 3.4948 0.9339 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5273 1.9928 1.8596 H 0 0 0 0 0 0 0 0 0 0 0 0
1 3 2 0 0 0 0
1 4 2 0 0 0 0
1 6 1 0 0 0 0
1 9 1 0 0 0 0
2 22 1 0 0 0 0
5 7 1 0 0 0 0
5 8 1 0 0 0 0
5 11 1 0 0 0 0
6 23 1 0 0 0 0
6 33 1 0 0 0 0
7 10 1 0 0 0 0
7 14 2 0 0 0 0
8 12 2 0 0 0 0
8 13 1 0 0 0 0
9 15 2 0 0 0 0
9 16 1 0 0 0 0
10 18 2 0 0 0 0
10 19 1 0 0 0 0
11 17 2 0 0 0 0
11 24 1 0 0 0 0
12 15 1 0 0 0 0
12 25 1 0 0 0 0
13 16 2 0 0 0 0
13 26 1 0 0 0 0
14 17 1 0 0 0 0
14 27 1 0 0 0 0
15 28 1 0 0 0 0
16 29 1 0 0 0 0
17 30 1 0 0 0 0
18 20 1 0 0 0 0
18 31 1 0 0 0 0
19 21 2 0 0 0 0
19 32 1 0 0 0 0
20 22 2 0 0 0 0
20 34 1 0 0 0 0
21 22 1 0 0 0 0
21 35 1 0 0 0 0
23 36 1 0 0 0 0
23 37 1 0 0 0 0
23 38 1 0 0 0 0
M END
$$$$