B95DGN
-OEChem-04042102303D
33 35 0 0 0 0 0 0 0999 V2000
-2.7465 -2.7598 0.3308 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6713 -2.1400 -0.7076 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5761 -0.3100 1.9197 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5850 0.5059 -0.6504 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.4827 -2.8470 -0.1881 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.4428 -0.7815 -0.0888 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1477 -0.6029 -0.3953 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4711 0.2488 0.0645 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6808 -2.2394 0.0481 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4953 -1.9362 -0.4581 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9537 0.7308 -0.4137 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2267 0.6494 -1.0376 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6956 0.8302 1.3124 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5956 0.0911 0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6751 1.5945 -1.2407 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2065 1.6315 -0.8916 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6754 1.8122 1.4582 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9524 0.3143 0.8836 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4309 2.2128 0.3561 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0318 1.8177 -1.0063 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6705 1.1775 0.0558 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0611 1.3306 -0.9256 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3365 -3.8497 -0.1605 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0637 0.2055 -2.0166 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1149 0.5284 2.1808 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0525 -0.5532 1.3362 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1885 2.0986 -2.0719 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7947 1.9435 -1.7497 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8503 2.2651 2.4298 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1938 2.9774 0.4697 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5909 2.4896 -1.6508 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7279 1.3598 0.2277 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5106 -0.0407 1.9334 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 2 0 0 0 0
2 10 2 0 0 0 0
3 18 1 0 0 0 0
3 33 1 0 0 0 0
4 7 1 0 0 0 0
4 11 1 0 0 0 0
4 22 1 0 0 0 0
5 9 1 0 0 0 0
5 10 1 0 0 0 0
5 23 1 0 0 0 0
6 7 2 0 0 0 0
6 8 1 0 0 0 0
6 9 1 0 0 0 0
7 10 1 0 0 0 0
8 12 2 0 0 0 0
8 13 1 0 0 0 0
11 14 2 0 0 0 0
11 15 1 0 0 0 0
12 16 1 0 0 0 0
12 24 1 0 0 0 0
13 17 2 0 0 0 0
13 25 1 0 0 0 0
14 18 1 0 0 0 0
14 26 1 0 0 0 0
15 20 2 0 0 0 0
15 27 1 0 0 0 0
16 19 2 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 21 2 0 0 0 0
19 30 1 0 0 0 0
20 21 1 0 0 0 0
20 31 1 0 0 0 0
21 32 1 0 0 0 0
M END
$$$$