BAS40I
-OEChem-04022114153D
36 37 0 1 0 0 0 0 0999 V2000
1.7186 -1.7595 -0.9240 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0736 -0.5966 -0.0425 N 0 0 0 0 0 0 0 0 0 0 0 0
2.6217 -1.4717 1.7811 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.0639 1.1033 1.1285 N 0 0 0 0 0 0 0 0 0 0 0 0
3.2996 0.4532 0.3435 C 0 0 2 0 0 0 0 0 0 0 0 0
2.1453 -0.3658 0.9609 C 0 0 1 0 0 0 0 0 0 0 0 0
-1.0608 -1.1086 -1.0026 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6759 0.3322 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2563 -0.9774 -0.0919 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7308 1.6544 -0.4446 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3277 -0.4507 -0.5832 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1170 0.3738 0.5177 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2538 -0.3877 -0.5169 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8022 2.5759 -1.0119 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5960 -0.5507 -1.1147 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6128 0.1885 -0.5143 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3006 0.9874 0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8947 0.8557 1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6070 0.3044 1.6324 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7550 -0.8190 -2.0124 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1077 -2.1982 -0.9147 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2111 1.3172 0.8335 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5641 -0.0699 1.9389 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0873 2.2452 0.2187 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1013 1.3088 -1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8293 -0.6183 -1.4986 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1870 0.1590 -0.6925 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5319 -1.3262 -0.0281 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2564 -1.1209 2.4972 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8388 -1.8955 2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3846 2.0820 -1.7953 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3366 3.4611 -1.4573 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4869 2.9125 -0.2272 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8011 -1.1821 -1.9719 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6277 0.1446 -0.8945 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0718 1.5747 1.0757 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 2 0 0 0 0
2 7 1 0 0 0 0
2 8 1 0 0 0 0
2 9 1 0 0 0 0
3 6 1 0 0 0 0
3 29 1 0 0 0 0
3 30 1 0 0 0 0
4 12 1 0 0 0 0
4 17 2 0 0 0 0
5 6 1 0 0 0 0
5 10 1 0 0 0 0
5 13 1 0 0 0 0
5 18 1 0 0 0 0
6 9 1 0 0 0 0
6 19 1 0 0 0 0
7 11 1 0 0 0 0
7 20 1 0 0 0 0
7 21 1 0 0 0 0
8 12 1 0 0 0 0
8 22 1 0 0 0 0
8 23 1 0 0 0 0
10 14 1 0 0 0 0
10 24 1 0 0 0 0
10 25 1 0 0 0 0
11 12 2 0 0 0 0
11 15 1 0 0 0 0
13 26 1 0 0 0 0
13 27 1 0 0 0 0
13 28 1 0 0 0 0
14 31 1 0 0 0 0
14 32 1 0 0 0 0
14 33 1 0 0 0 0
15 16 2 0 0 0 0
15 34 1 0 0 0 0
16 17 1 0 0 0 0
16 35 1 0 0 0 0
17 36 1 0 0 0 0
M END
$$$$