B40XZF
-OEChem-04022117353D
33 35 0 0 0 0 0 0 0999 V2000
4.3615 0.3948 0.1205 S 0 0 0 0 0 0 0 0 0 0 0 0
4.7175 0.7432 1.4894 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1889 -0.5434 -0.6247 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3686 -0.8651 -0.0194 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.6312 -2.9021 0.0762 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.4642 -1.6369 -0.0207 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.0072 -2.8818 0.0376 N 0 0 0 0 0 0 0 0 0 0 0 0
2.7202 -0.1996 0.0965 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0981 -1.1513 0.0589 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2572 -1.6439 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2991 -1.0431 -0.9315 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8302 0.1682 1.1058 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9882 -1.5189 -0.9503 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5193 -0.3077 1.0868 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4582 0.5211 -0.0732 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2950 1.9154 -0.7997 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4430 1.2628 -0.6773 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5634 1.1705 0.4767 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5331 2.6537 -0.7318 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6537 2.5613 0.4221 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6383 3.3029 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9728 -1.3365 -1.7317 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1361 0.8266 1.9139 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6747 -2.1732 -1.7603 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1532 -0.0195 1.8916 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3009 2.3400 -0.8258 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9550 1.7015 -1.8147 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6126 2.6046 -0.2986 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6143 0.8200 -1.2159 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3657 0.6203 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7546 3.2303 -1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5138 3.0673 0.8509 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7110 4.3855 -0.2288 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
1 3 2 0 0 0 0
1 8 1 0 0 0 0
1 16 1 0 0 0 0
4 6 1 0 0 0 0
4 10 1 0 0 0 0
4 15 1 0 0 0 0
5 7 1 0 0 0 0
5 10 2 0 0 0 0
6 7 2 0 0 0 0
8 11 2 0 0 0 0
8 12 1 0 0 0 0
9 10 1 0 0 0 0
9 13 2 0 0 0 0
9 14 1 0 0 0 0
11 13 1 0 0 0 0
11 22 1 0 0 0 0
12 14 2 0 0 0 0
12 23 1 0 0 0 0
13 24 1 0 0 0 0
14 25 1 0 0 0 0
15 17 2 0 0 0 0
15 18 1 0 0 0 0
16 26 1 0 0 0 0
16 27 1 0 0 0 0
16 28 1 0 0 0 0
17 19 1 0 0 0 0
17 29 1 0 0 0 0
18 20 2 0 0 0 0
18 30 1 0 0 0 0
19 21 2 0 0 0 0
19 31 1 0 0 0 0
20 21 1 0 0 0 0
20 32 1 0 0 0 0
21 33 1 0 0 0 0
M END
$$$$