B1TX9F
-OEChem-04022112233D
36 36 0 0 0 0 0 0 0999 V2000
2.0783 0.2018 0.9852 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6202 -0.1291 -1.2651 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5368 -1.1504 -0.0064 N 0 3 0 0 0 0 0 0 0 0 0 0
-1.4633 -0.0651 0.1062 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9150 -2.4947 0.3607 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0675 -1.1705 -1.4372 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7142 -0.8977 0.9332 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7618 1.2682 -0.1753 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1729 -0.4234 0.4962 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7698 2.2429 -0.0671 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8191 0.5513 0.6046 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1357 1.6781 -0.5947 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5205 1.8845 0.3231 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9324 -0.1347 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2941 -0.5026 0.4621 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2722 -0.8586 -0.6434 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6934 -3.2603 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1192 -2.7401 -0.3507 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5907 -2.4811 1.4066 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3656 -2.2009 -1.6628 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9641 -0.5607 -1.5491 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2721 -0.8820 -2.1319 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1523 -1.8659 1.2004 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3471 -0.4109 1.8419 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5045 -0.3229 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1406 -1.4325 0.7352 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9825 3.2866 -0.2828 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4052 1.3252 -1.5888 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8966 1.4988 0.1605 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1590 2.7721 -0.7062 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2886 2.6487 0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1769 -1.3583 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6812 0.3504 1.0291 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4102 -0.0184 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2475 -1.1186 -0.2206 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9128 -1.7133 -1.2262 H 0 0 0 0 0 0 0 0 0 0 0 0
1 11 1 0 0 0 0
1 14 1 0 0 0 0
2 14 2 0 0 0 0
3 4 1 0 0 0 0
3 5 1 0 0 0 0
3 6 1 0 0 0 0
3 7 1 0 0 0 0
4 8 2 0 0 0 0
4 9 1 0 0 0 0
5 17 1 0 0 0 0
5 18 1 0 0 0 0
5 19 1 0 0 0 0
6 20 1 0 0 0 0
6 21 1 0 0 0 0
6 22 1 0 0 0 0
7 23 1 0 0 0 0
7 24 1 0 0 0 0
7 25 1 0 0 0 0
8 10 1 0 0 0 0
8 12 1 0 0 0 0
9 11 2 0 0 0 0
9 26 1 0 0 0 0
10 13 2 0 0 0 0
10 27 1 0 0 0 0
11 13 1 0 0 0 0
12 28 1 0 0 0 0
12 29 1 0 0 0 0
12 30 1 0 0 0 0
13 31 1 0 0 0 0
14 15 1 0 0 0 0
15 16 1 0 0 0 0
15 32 1 0 0 0 0
15 33 1 0 0 0 0
16 34 1 0 0 0 0
16 35 1 0 0 0 0
16 36 1 0 0 0 0
M CHG 1 3 1
M END
$$$$