B28FJT
-OEChem-04012113223D
40 42 0 0 0 0 0 0 0999 V2000
4.8344 -1.6857 -0.0500 S 0 0 0 0 0 0 0 0 0 0 0 0
1.1342 5.4767 -0.0947 F 0 0 0 0 0 0 0 0 0 0 0 0
-5.4036 -1.0856 0.0515 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1270 -2.5775 -1.1634 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5400 -0.4170 0.0654 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2556 -3.0700 0.0654 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9853 -0.6102 0.0002 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.8479 -1.6405 0.0224 N 0 0 0 0 0 0 0 0 0 0 0 0
5.0187 -2.5505 1.4121 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.5870 0.6156 -0.0087 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3876 -0.8638 -0.0116 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8825 1.8742 -0.0317 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9392 0.3661 0.0083 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1175 -1.3686 -0.0348 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2566 0.0481 0.5713 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8634 -2.0247 -0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0399 -1.0379 0.0271 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6281 -0.2054 0.5596 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2350 -2.2784 -0.6177 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5300 2.4971 1.1654 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5538 2.4681 -1.2503 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1512 3.7142 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1276 3.6851 -1.2717 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2385 -1.8267 0.0494 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4801 4.3082 -0.0745 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.6383 -1.8107 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7329 1.1003 0.0072 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9764 0.8611 1.2076 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2023 -2.7473 -1.0771 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2952 0.4927 1.0582 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5938 -3.1923 -1.0826 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7950 2.0590 2.1256 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8206 1.9948 -2.1924 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4222 4.2014 2.0759 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3841 4.1477 -2.2202 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2191 -3.5561 1.3493 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4993 -2.0785 2.1877 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.4578 -1.0873 0.0718 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7037 -2.4163 0.9816 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7216 -2.4393 -0.8184 H 0 0 0 0 0 0 0 0 0 0 0 0
1 4 2 0 0 0 0
1 5 2 0 0 0 0
1 9 1 0 0 0 0
1 14 1 0 0 0 0
2 25 1 0 0 0 0
3 24 1 0 0 0 0
3 26 1 0 0 0 0
6 24 2 0 0 0 0
7 8 1 0 0 0 0
7 10 1 0 0 0 0
7 11 1 0 0 0 0
8 17 2 0 0 0 0
9 36 1 0 0 0 0
9 37 1 0 0 0 0
10 12 1 0 0 0 0
10 13 2 0 0 0 0
11 15 2 0 0 0 0
11 16 1 0 0 0 0
12 20 2 0 0 0 0
12 21 1 0 0 0 0
13 17 1 0 0 0 0
13 27 1 0 0 0 0
14 18 2 0 0 0 0
14 19 1 0 0 0 0
15 18 1 0 0 0 0
15 28 1 0 0 0 0
16 19 2 0 0 0 0
16 29 1 0 0 0 0
17 24 1 0 0 0 0
18 30 1 0 0 0 0
19 31 1 0 0 0 0
20 22 1 0 0 0 0
20 32 1 0 0 0 0
21 23 2 0 0 0 0
21 33 1 0 0 0 0
22 25 2 0 0 0 0
22 34 1 0 0 0 0
23 25 1 0 0 0 0
23 35 1 0 0 0 0
26 38 1 0 0 0 0
26 39 1 0 0 0 0
26 40 1 0 0 0 0
M END
$$$$