BGJ26K
-OEChem-04022114213D
46 48 0 0 0 0 0 0 0999 V2000
3.6114 0.4587 1.4746 S 0 0 0 0 0 0 0 0 0 0 0 0
4.5594 1.5496 1.5399 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1716 -0.2212 2.6734 O 0 0 0 0 0 0 0 0 0 0 0 0
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0.9701 2.1835 -0.6557 N 0 0 0 0 0 0 0 0 0 0 0 0
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3.3748 -1.9622 0.2774 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3194 -1.2161 -1.7740 C 0 0 0 0 0 0 0 0 0 0 0 0
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4.5680 -2.5414 -1.8648 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1791 1.0367 0.6204 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8815 0.5034 0.7373 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1170 1.2721 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6428 3.2173 -1.6108 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2241 0.3247 0.0943 C 0 0 0 0 0 0 0 0 0 0 0 0
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-5.8598 0.4020 -0.9021 C 0 0 0 0 0 0 0 0 0 0 0 0
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5.1194 0.7346 -0.9099 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6050 0.0619 -1.5595 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4235 -1.7752 -0.2319 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1635 -2.3389 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2823 -1.3809 -1.2743 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5378 -0.8444 -2.7813 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5613 -3.9408 -0.5654 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0636 -3.2894 0.0921 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1968 -3.2932 -2.3544 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6730 -2.4148 -2.4861 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5577 -0.3246 1.3509 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2456 2.7426 -2.5113 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0993 3.8813 -1.1607 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5438 3.7847 -1.8593 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5458 1.9094 -1.0694 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5044 1.3909 -1.1338 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8204 1.2369 -1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9353 -1.4986 1.1955 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.9736 0.0995 -1.1874 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0513 -2.5797 1.5669 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.0950 -1.8089 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
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22 24 2 0 0 0 0
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24 45 1 0 0 0 0
25 46 1 0 0 0 0
M END
$$$$