BOA4B8
-OEChem-04042103343D
57 61 0 0 0 0 0 0 0999 V2000
1.5521 3.1634 -0.7583 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4269 -2.9430 1.3320 O 0 0 0 0 0 0 0 0 0 0 0 0
5.9713 0.7632 -1.0026 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5351 4.5273 0.0008 O 0 0 0 0 0 0 0 0 0 0 0 0
6.0807 -1.8737 -0.1407 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5241 2.1527 1.0379 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1332 -1.0211 0.9941 N 0 0 0 0 0 0 0 0 0 0 0 0
-4.2953 -2.9755 -0.2248 N 0 0 0 0 0 0 0 0 0 0 0 0
-6.0293 -2.8039 -1.6015 N 0 0 0 0 0 0 0 0 0 0 0 0
0.1025 0.2959 0.5576 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2019 0.9146 0.0861 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0328 1.2285 0.5147 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0871 -1.6382 1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4867 0.2378 0.0071 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5775 2.4409 -0.0031 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5516 -1.0952 0.4408 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8404 2.2982 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3296 -1.7739 0.9616 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0488 -2.0165 0.3723 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3723 1.1389 0.8655 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3436 -2.6453 0.8971 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6499 0.8488 -0.4767 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3716 3.5598 -0.1903 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7616 -1.8005 0.3892 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8546 0.1436 -0.5269 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2081 2.2530 0.6899 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7113 3.4547 0.1659 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9104 -1.1782 -0.0949 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2089 -4.0453 -1.0706 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.4036 -2.2591 -0.5819 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.2897 -3.9177 -1.9110 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2210 0.6618 -2.4030 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9540 5.7131 -0.5381 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9186 -1.8089 1.0119 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5303 -1.0033 2.2669 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8210 -2.5600 2.0268 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5458 -2.7482 -0.2759 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2809 -1.1855 -0.2991 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8152 0.2589 1.3048 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1600 -3.5925 1.4158 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8877 -1.9688 1.5645 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6418 1.8789 -0.8208 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9092 4.4483 -0.6007 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8224 -2.8338 0.7218 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4161 -4.7771 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7018 -1.3552 -0.0685 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6993 1.2562 1.3717 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5726 -4.5713 -2.7232 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1467 1.1994 -2.6257 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4052 1.1188 -2.9721 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3447 -0.3850 -2.6979 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8133 -2.4071 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4026 -2.2218 1.8845 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2237 -0.7764 1.2091 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1832 6.1216 0.1243 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5853 5.5544 -1.5573 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7497 6.4627 -0.6007 H 0 0 0 0 0 0 0 0 0 0 0 0
1 17 2 0 0 0 0
2 18 2 0 0 0 0
3 25 1 0 0 0 0
3 32 1 0 0 0 0
4 27 1 0 0 0 0
4 33 1 0 0 0 0
5 28 1 0 0 0 0
5 34 1 0 0 0 0
6 26 1 0 0 0 0
6 47 1 0 0 0 0
7 10 1 0 0 0 0
7 13 1 0 0 0 0
7 18 1 0 0 0 0
8 21 1 0 0 0 0
8 29 1 0 0 0 0
8 30 1 0 0 0 0
9 30 2 0 0 0 0
9 31 1 0 0 0 0
10 11 2 0 0 0 0
10 12 1 0 0 0 0
11 14 1 0 0 0 0
11 17 1 0 0 0 0
12 15 1 0 0 0 0
12 20 2 0 0 0 0
13 19 1 0 0 0 0
13 35 1 0 0 0 0
13 36 1 0 0 0 0
14 16 1 0 0 0 0
14 22 2 0 0 0 0
15 17 1 0 0 0 0
15 23 2 0 0 0 0
16 18 1 0 0 0 0
16 24 2 0 0 0 0
19 21 1 0 0 0 0
19 37 1 0 0 0 0
19 38 1 0 0 0 0
20 26 1 0 0 0 0
20 39 1 0 0 0 0
21 40 1 0 0 0 0
21 41 1 0 0 0 0
22 25 1 0 0 0 0
22 42 1 0 0 0 0
23 27 1 0 0 0 0
23 43 1 0 0 0 0
24 28 1 0 0 0 0
24 44 1 0 0 0 0
25 28 2 0 0 0 0
26 27 2 0 0 0 0
29 31 2 0 0 0 0
29 45 1 0 0 0 0
30 46 1 0 0 0 0
31 48 1 0 0 0 0
32 49 1 0 0 0 0
32 50 1 0 0 0 0
32 51 1 0 0 0 0
33 55 1 0 0 0 0
33 56 1 0 0 0 0
33 57 1 0 0 0 0
34 52 1 0 0 0 0
34 53 1 0 0 0 0
34 54 1 0 0 0 0
M END
$$$$