BU1ZY5
-OEChem-04012117482D
51 54 0 1 0 0 0 0 0999 V2000
11.3200 0.4119 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
7.8104 -2.9839 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0000 0.4310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0000 -1.3011 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.4339 -0.4001 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.4088 -2.4246 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.5000 -0.4351 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.0000 -1.3011 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
10.1906 -0.8011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4088 -0.1776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0000 -1.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.1906 -1.8011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4339 -2.2021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.6313 0.7973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.0846 -0.2664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.0846 -2.3358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.9907 -0.7803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.9907 -1.8219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.5869 1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.8983 1.4775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5000 -0.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.8094 2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1208 2.4524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.0764 2.7472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0000 0.4310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5000 1.2970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0000 2.1630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5000 1.2970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5000 3.0290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.1630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5000 3.0290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6701 -0.7761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4174 -1.5131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1077 -1.9117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5468 -3.0290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.0774 0.3535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.0774 -2.9557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8100 0.1019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.5264 -0.4682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.5264 -2.1340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3058 1.2948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.4019 2.2498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6663 2.8741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.2143 3.3516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4174 0.2189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1077 -0.1796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6200 2.1630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1900 0.7600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8100 3.5660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3800 2.1630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1900 3.5660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 19 1 0 0 0 0
2 13 2 0 0 0 0
3 21 1 0 0 0 0
3 25 1 0 0 0 0
4 21 2 0 0 0 0
5 8 1 0 0 0 0
5 10 2 0 0 0 0
6 12 1 0 0 0 0
6 13 1 0 0 0 0
6 35 1 0 0 0 0
7 11 1 0 0 0 0
7 21 1 0 0 0 0
7 38 1 0 0 0 0
8 11 1 0 0 0 0
8 13 1 0 0 0 0
8 32 1 0 0 0 0
9 10 1 0 0 0 0
9 12 1 0 0 0 0
9 15 2 0 0 0 0
10 14 1 0 0 0 0
11 33 1 0 0 0 0
11 34 1 0 0 0 0
12 16 2 0 0 0 0
14 19 1 0 0 0 0
14 20 2 0 0 0 0
15 17 1 0 0 0 0
15 36 1 0 0 0 0
16 18 1 0 0 0 0
16 37 1 0 0 0 0
17 18 2 0 0 0 0
17 39 1 0 0 0 0
18 40 1 0 0 0 0
19 22 2 0 0 0 0
20 23 1 0 0 0 0
20 41 1 0 0 0 0
22 24 1 0 0 0 0
22 42 1 0 0 0 0
23 24 2 0 0 0 0
23 43 1 0 0 0 0
24 44 1 0 0 0 0
25 26 1 0 0 0 0
25 45 1 0 0 0 0
25 46 1 0 0 0 0
26 27 2 0 0 0 0
26 28 1 0 0 0 0
27 29 1 0 0 0 0
27 47 1 0 0 0 0
28 30 2 0 0 0 0
28 48 1 0 0 0 0
29 31 2 0 0 0 0
29 49 1 0 0 0 0
30 31 1 0 0 0 0
30 50 1 0 0 0 0
31 51 1 0 0 0 0
M END
$$$$