BCP4T3
-OEChem-04042106033D
50 53 0 1 0 0 0 0 0999 V2000
-5.6333 1.4498 0.5109 F 0 0 0 0 0 0 0 0 0 0 0 0
-5.6814 0.5364 -1.4556 F 0 0 0 0 0 0 0 0 0 0 0 0
-7.0833 -0.1108 0.0753 F 0 0 0 0 0 0 0 0 0 0 0 0
2.7684 2.4682 1.1551 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1783 -2.4914 -2.0336 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0991 -2.0570 -1.2242 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0765 1.6991 -0.1931 N 0 0 0 0 0 0 0 0 0 0 0 0
3.0913 0.5133 -0.0769 N 0 0 0 0 0 0 0 0 0 0 0 0
7.0146 -0.5482 1.0280 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.1870 2.3502 -0.3781 C 0 0 1 0 0 0 0 0 0 0 0 0
-0.8605 1.4240 -1.5518 C 0 0 2 0 0 0 0 0 0 0 0 0
-1.9872 1.4585 0.5698 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0313 0.4440 -1.6538 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8839 0.6613 -0.3862 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1679 2.7848 0.1498 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4635 0.7718 -1.1437 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4443 -0.6047 0.2155 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3618 1.6202 0.3586 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8210 -0.7935 0.3368 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5635 -1.5938 0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3168 -1.9712 0.8958 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7835 0.2511 -0.1246 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0594 -2.7717 1.2122 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4361 -2.9605 1.3335 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4101 0.1440 0.2857 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0049 -0.9984 -0.2383 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1158 0.9406 1.1806 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2974 -1.2978 0.1611 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4035 0.5544 1.5164 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3193 -1.8729 -1.1784 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7976 3.2067 -0.6864 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7235 1.9929 -2.4787 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5755 2.0490 1.2809 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3257 0.8140 1.1602 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6841 -0.5865 -1.7846 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6397 0.6752 -2.5373 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6806 1.3491 -0.6842 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1794 2.9790 1.2267 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5258 3.6800 -0.3711 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1200 0.6282 -2.0077 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3335 -0.1908 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4877 -1.4718 0.5658 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6349 -0.1162 -0.7274 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.3849 -2.1406 1.0006 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3737 -3.5423 1.5522 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8219 -3.8777 1.7687 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7543 1.8436 1.6456 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8248 -2.1780 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9975 1.1408 2.2099 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7073 -3.0784 -2.6629 H 0 0 0 0 0 0 0 0 0 0 0 0
1 22 1 0 0 0 0
2 22 1 0 0 0 0
3 22 1 0 0 0 0
4 18 2 0 0 0 0
5 30 1 0 0 0 0
5 50 1 0 0 0 0
6 30 2 0 0 0 0
7 15 1 0 0 0 0
7 16 1 0 0 0 0
7 18 1 0 0 0 0
8 18 1 0 0 0 0
8 25 1 0 0 0 0
8 43 1 0 0 0 0
9 28 2 0 0 0 0
9 29 1 0 0 0 0
10 11 1 0 0 0 0
10 12 1 0 0 0 0
10 15 1 0 0 0 0
10 31 1 0 0 0 0
11 13 1 0 0 0 0
11 16 1 0 0 0 0
11 32 1 0 0 0 0
12 14 1 0 0 0 0
12 33 1 0 0 0 0
12 34 1 0 0 0 0
13 14 1 0 0 0 0
13 35 1 0 0 0 0
13 36 1 0 0 0 0
14 17 1 0 0 0 0
14 37 1 0 0 0 0
15 38 1 0 0 0 0
15 39 1 0 0 0 0
16 40 1 0 0 0 0
16 41 1 0 0 0 0
17 19 1 0 0 0 0
17 20 2 0 0 0 0
19 21 2 0 0 0 0
19 22 1 0 0 0 0
20 23 1 0 0 0 0
20 42 1 0 0 0 0
21 24 1 0 0 0 0
21 44 1 0 0 0 0
23 24 2 0 0 0 0
23 45 1 0 0 0 0
24 46 1 0 0 0 0
25 26 2 0 0 0 0
25 27 1 0 0 0 0
26 28 1 0 0 0 0
26 30 1 0 0 0 0
27 29 2 0 0 0 0
27 47 1 0 0 0 0
28 48 1 0 0 0 0
29 49 1 0 0 0 0
M END
$$$$