B6ILT4
-OEChem-04022103403D
32 33 0 0 0 0 0 0 0999 V2000
7.2544 -0.9042 -0.0037 S 0 0 0 0 0 0 0 0 0 0 0 0
3.7478 2.6354 0.0003 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3880 -1.9318 0.0014 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8116 -1.3294 0.0018 O 0 0 0 0 0 0 0 0 0 0 0 0
5.2582 0.8678 -0.0012 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6239 -1.3784 -0.0017 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.9511 0.7234 0.0001 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.6604 0.6707 0.0014 N 0 0 0 0 0 0 0 0 0 0 0 0
0.5406 0.0484 0.0027 N 0 0 0 0 0 0 0 0 0 0 0 0
2.9351 0.3836 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9465 1.2745 0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2708 -1.0772 0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3108 0.3347 -0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6468 -0.4499 -0.0022 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5460 0.8585 0.0027 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3133 1.3046 -0.0022 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6495 -1.0184 0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.6546 0.9213 -0.0026 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.9906 -1.4017 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.9932 -0.4318 -0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8229 -0.1005 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9773 1.5847 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8832 -2.3607 -0.0026 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4002 1.9539 0.0025 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0631 2.3624 -0.0031 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9313 -1.8261 0.0019 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7815 1.7261 -0.0006 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.4353 1.6764 -0.0038 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2558 -2.4550 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.0374 -0.7303 -0.0017 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6850 1.6852 0.0007 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6289 3.0463 -0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0
1 14 2 0 0 0 0
2 11 1 0 0 0 0
2 32 1 0 0 0 0
3 12 2 0 0 0 0
4 21 2 0 0 0 0
5 11 1 0 0 0 0
5 14 1 0 0 0 0
5 22 1 0 0 0 0
6 12 1 0 0 0 0
6 14 1 0 0 0 0
6 23 1 0 0 0 0
7 13 1 0 0 0 0
7 21 1 0 0 0 0
7 27 1 0 0 0 0
8 9 1 0 0 0 0
8 21 1 0 0 0 0
8 31 1 0 0 0 0
9 15 2 0 0 0 0
10 11 2 0 0 0 0
10 12 1 0 0 0 0
10 15 1 0 0 0 0
13 16 2 0 0 0 0
13 17 1 0 0 0 0
15 24 1 0 0 0 0
16 18 1 0 0 0 0
16 25 1 0 0 0 0
17 19 2 0 0 0 0
17 26 1 0 0 0 0
18 20 2 0 0 0 0
18 28 1 0 0 0 0
19 20 1 0 0 0 0
19 29 1 0 0 0 0
20 30 1 0 0 0 0
M END
$$$$