B1UTB6
-OEChem-04022101533D
40 42 0 1 0 0 0 0 0999 V2000
-5.4735 -0.2678 0.8369 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2170 1.6851 0.4187 N 0 0 2 0 0 0 0 0 0 0 0 0
-0.1988 -0.4453 -0.9837 N 0 0 3 0 0 0 0 0 0 0 0 0
0.7093 0.6373 -0.5238 C 0 0 2 0 0 0 0 0 0 0 0 0
-1.1835 1.9994 0.1148 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5169 -0.4221 -0.5338 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0377 0.7516 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9563 -0.0186 0.0816 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0307 2.9023 0.3888 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2522 -1.4373 -1.9487 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2009 0.0989 -0.5368 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3741 -1.5310 -0.6428 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3664 0.7998 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8326 -0.7409 1.2684 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1878 -0.3173 0.3946 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6922 -1.4815 -0.1805 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3220 -0.5059 0.0316 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3581 0.8671 -1.8078 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9536 -1.3458 1.8369 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1984 -1.2283 1.2185 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9567 1.1680 -1.4493 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2776 2.5217 -0.8467 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5710 2.6648 0.8962 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6419 3.6374 1.1026 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0464 3.3665 -0.6037 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0623 2.6980 0.6929 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2196 -1.1783 -2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4520 -1.5193 -2.7844 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3560 -2.4181 -1.4726 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0276 -2.4639 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7562 1.7186 0.9403 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8706 -0.8441 1.7635 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3260 -2.3592 -0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2993 -0.4246 -0.4367 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7630 0.4353 -2.6168 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0873 1.9180 -1.6656 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3994 0.8589 -2.1503 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8573 -1.9086 2.7608 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0711 -1.6994 1.6611 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6470 0.6157 1.2049 H 0 0 0 0 0 0 0 0 0 0 0 0
1 15 1 0 0 0 0
1 40 1 0 0 0 0
2 4 1 0 0 0 0
2 5 1 0 0 0 0
2 9 1 0 0 0 0
3 4 1 0 0 0 0
3 6 1 0 0 0 0
3 10 1 0 0 0 0
4 8 1 0 0 0 0
4 21 1 0 0 0 0
5 7 1 0 0 0 0
5 22 1 0 0 0 0
5 23 1 0 0 0 0
6 7 2 0 0 0 0
6 12 1 0 0 0 0
7 13 1 0 0 0 0
8 11 1 0 0 0 0
8 14 2 0 0 0 0
9 24 1 0 0 0 0
9 25 1 0 0 0 0
9 26 1 0 0 0 0
10 27 1 0 0 0 0
10 28 1 0 0 0 0
10 29 1 0 0 0 0
11 17 2 0 0 0 0
11 18 1 0 0 0 0
12 16 2 0 0 0 0
12 30 1 0 0 0 0
13 15 2 0 0 0 0
13 31 1 0 0 0 0
14 19 1 0 0 0 0
14 32 1 0 0 0 0
15 16 1 0 0 0 0
16 33 1 0 0 0 0
17 20 1 0 0 0 0
17 34 1 0 0 0 0
18 35 1 0 0 0 0
18 36 1 0 0 0 0
18 37 1 0 0 0 0
19 20 2 0 0 0 0
19 38 1 0 0 0 0
20 39 1 0 0 0 0
M END
$$$$