B25UQB
-OEChem-04022108312D
36 39 0 0 0 0 0 0 0999 V2000
2.2190 0.4950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8741 1.0055 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.6045 2.1836 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.9976 -0.4033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0967 0.0306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0915 -1.4407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4976 1.7874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2354 -2.0341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4976 1.7874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2271 -0.5428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8986 0.0306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2969 -1.5821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1211 1.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0796 -1.8887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9630 2.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3081 -3.1166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0323 2.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8992 1.2281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1774 -2.9693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2857 -3.5874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4768 3.5874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5184 3.5874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6716 -0.2674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3833 -0.3560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7833 -1.9294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7256 1.1435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5851 -1.5296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3430 2.6741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7945 -3.4639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6522 2.6741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7391 -3.2318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3344 -4.2055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1648 4.1231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8305 4.1231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.3216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0262 2.6381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 18 2 0 0 0 0
2 5 1 0 0 0 0
2 7 1 0 0 0 0
2 18 1 0 0 0 0
3 18 1 0 0 0 0
3 35 1 0 0 0 0
3 36 1 0 0 0 0
4 5 2 0 0 0 0
4 6 1 0 0 0 0
4 11 1 0 0 0 0
5 10 1 0 0 0 0
6 8 1 0 0 0 0
6 14 2 0 0 0 0
7 9 1 0 0 0 0
7 15 2 0 0 0 0
8 12 1 0 0 0 0
8 16 2 0 0 0 0
9 13 1 0 0 0 0
9 17 2 0 0 0 0
10 12 2 0 0 0 0
10 23 1 0 0 0 0
11 13 2 0 0 0 0
11 24 1 0 0 0 0
12 25 1 0 0 0 0
13 26 1 0 0 0 0
14 19 1 0 0 0 0
14 27 1 0 0 0 0
15 21 1 0 0 0 0
15 28 1 0 0 0 0
16 20 1 0 0 0 0
16 29 1 0 0 0 0
17 22 1 0 0 0 0
17 30 1 0 0 0 0
19 20 2 0 0 0 0
19 31 1 0 0 0 0
20 32 1 0 0 0 0
21 22 2 0 0 0 0
21 33 1 0 0 0 0
22 34 1 0 0 0 0
M END
$$$$