BUR85T
-OEChem-04042103543D
49 50 0 0 0 0 0 0 0999 V2000
-1.5265 -1.6526 0.1847 S 0 0 0 0 0 0 0 0 0 0 0 0
-1.6185 -2.5169 -0.9837 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6791 -2.2202 1.5181 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0251 0.1800 -0.0822 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8263 1.1302 -0.1782 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8061 -0.4325 0.0566 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3715 0.9102 -0.0998 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4902 0.4366 -0.0875 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0187 -0.8464 0.0801 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2966 0.1873 1.2059 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3195 -0.0891 -1.1941 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5360 -0.0731 0.0238 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8834 0.2512 1.1547 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8612 -0.0197 -1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6476 -0.3902 1.2385 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6256 -0.6611 -1.1622 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8143 1.4935 -0.1462 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3007 1.1502 1.1045 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3237 0.8738 -1.2954 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7702 -0.1527 2.5622 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8172 -0.7304 -2.4467 C 0 0 0 0 0 0 0 0 0 0 0 0
8.8741 0.6486 0.0458 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8873 2.5235 -0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9882 -0.5379 -0.9116 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9477 -0.4088 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8782 1.6936 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8903 1.8847 0.6169 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4071 1.6291 0.7276 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4666 1.4822 -1.0306 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5192 -0.7774 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4316 -0.6613 0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3698 0.5915 2.0651 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3300 0.1092 -2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2315 -0.5572 2.2244 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1916 -1.0387 -2.0798 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6902 1.6351 1.9966 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7306 1.1440 -2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1630 0.5598 3.3006 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6936 -0.0403 2.6437 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1270 -1.1278 2.9057 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1466 -1.7697 -2.5311 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2514 -0.2295 -3.3225 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7460 -0.6135 -2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9352 1.3362 0.8955 H 0 0 0 0 0 0 0 0 0 0 0 0
9.6925 -0.0728 0.1332 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0245 1.2236 -0.8734 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8710 2.0513 -0.1675 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7900 3.2783 0.5347 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8348 3.0526 -1.2107 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
1 3 2 0 0 0 0
1 6 1 0 0 0 0
1 9 1 0 0 0 0
4 5 1 0 0 0 0
4 7 1 0 0 0 0
4 24 1 0 0 0 0
4 25 1 0 0 0 0
5 8 1 0 0 0 0
5 26 1 0 0 0 0
5 27 1 0 0 0 0
6 10 2 0 0 0 0
6 11 1 0 0 0 0
7 12 1 0 0 0 0
7 28 1 0 0 0 0
7 29 1 0 0 0 0
8 13 2 0 0 0 0
8 14 1 0 0 0 0
9 15 2 0 0 0 0
9 16 1 0 0 0 0
10 18 1 0 0 0 0
10 20 1 0 0 0 0
11 19 2 0 0 0 0
11 21 1 0 0 0 0
12 22 1 0 0 0 0
12 30 1 0 0 0 0
12 31 1 0 0 0 0
13 15 1 0 0 0 0
13 32 1 0 0 0 0
14 16 2 0 0 0 0
14 33 1 0 0 0 0
15 34 1 0 0 0 0
16 35 1 0 0 0 0
17 18 2 0 0 0 0
17 19 1 0 0 0 0
17 23 1 0 0 0 0
18 36 1 0 0 0 0
19 37 1 0 0 0 0
20 38 1 0 0 0 0
20 39 1 0 0 0 0
20 40 1 0 0 0 0
21 41 1 0 0 0 0
21 42 1 0 0 0 0
21 43 1 0 0 0 0
22 44 1 0 0 0 0
22 45 1 0 0 0 0
22 46 1 0 0 0 0
23 47 1 0 0 0 0
23 48 1 0 0 0 0
23 49 1 0 0 0 0
M END
$$$$