B9Q1KN
-OEChem-04022114213D
47 49 0 0 0 0 0 0 0999 V2000
4.1526 0.9094 -1.1428 S 0 0 0 0 0 0 0 0 0 0 0 0
4.9034 -2.6002 1.5711 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2180 0.5330 -2.5388 O 0 0 0 0 0 0 0 0 0 0 0 0
4.7454 2.1443 -0.6754 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5332 -0.5793 -1.0948 O 0 0 0 0 0 0 0 0 0 0 0 0
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-3.8427 0.4456 0.5494 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5811 -0.2155 1.2882 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3056 -1.7474 -0.6167 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3648 -1.3145 1.9918 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1005 -2.7822 0.1673 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4538 0.9072 -0.6621 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0339 1.6807 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5312 0.1328 -1.3655 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6914 1.6799 0.7988 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2312 0.9054 0.0954 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1887 0.1318 -0.9866 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2699 2.5166 1.9629 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6455 0.1714 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1342 -0.0661 0.2803 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.2163 0.3224 1.0701 C 0 0 0 0 0 0 0 0 0 0 0 0
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-7.6806 -1.0754 -0.2488 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5275 -0.3114 1.5676 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9604 0.7602 1.6054 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4892 -1.8901 -1.6855 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2396 -1.8823 -0.4086 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4402 -1.2322 1.7933 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2188 -1.2448 3.0743 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7600 -3.7901 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1718 -2.7230 -0.0592 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7486 2.2848 0.9727 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8374 -0.4786 -2.2098 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4555 -0.4955 -1.5846 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4677 3.2643 1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1536 1.8895 2.7546 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1148 3.0600 2.4003 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8379 1.4699 1.2533 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7855 1.0904 1.3336 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0812 1.0177 1.8947 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5405 -1.3083 -1.4296 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.3322 0.1201 1.4205 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7486 -2.1597 -1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.6719 -1.4683 -0.4547 H 0 0 0 0 0 0 0 0 0 0 0 0
1 3 2 0 0 0 0
1 4 2 0 0 0 0
1 6 1 0 0 0 0
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2 11 1 0 0 0 0
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5 20 2 0 0 0 0
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13 14 2 0 0 0 0
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21 22 2 0 0 0 0
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23 25 2 0 0 0 0
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24 26 2 0 0 0 0
24 45 1 0 0 0 0
25 26 1 0 0 0 0
25 46 1 0 0 0 0
26 47 1 0 0 0 0
M END
$$$$