BI4MC7
-OEChem-04022109503D
49 52 0 1 0 0 0 0 0999 V2000
2.5587 -0.1610 1.5648 S 0 0 0 0 0 0 0 0 0 0 0 0
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6.0157 -0.6346 -0.3742 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5751 0.8165 2.6362 O 0 0 0 0 0 0 0 0 0 0 0 0
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-4.3452 1.9372 -0.6559 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1555 3.0805 0.7819 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4780 0.4193 0.2547 N 0 0 1 0 0 0 0 0 0 0 0 0
-2.8852 0.0650 -0.7676 N 0 0 0 0 0 0 0 0 0 0 0 0
3.6919 -0.4961 -0.9109 C 0 0 1 0 0 0 0 0 0 0 0 0
3.9371 0.4537 -2.0818 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1473 1.7786 -0.2711 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9911 1.5976 -1.7741 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8693 -1.4200 -0.6587 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3210 -1.2055 0.3690 C 0 0 1 0 0 0 0 0 0 0 0 0
-4.3893 -1.8793 -0.5931 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9419 -0.1439 0.8517 C 0 0 0 0 0 0 0 0 0 0 0 0
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-1.1009 0.9497 0.3864 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1499 0.9999 0.9641 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4690 -1.2865 0.1763 C 0 0 0 0 0 0 0 0 0 0 0 0
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4.0099 2.4218 -0.0585 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2790 2.2565 0.1759 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2304 2.5077 -2.3311 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9608 1.3094 -2.0148 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0568 -2.0283 -1.5518 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6747 -2.0979 0.1774 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8244 -0.6486 1.1512 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6617 -2.4615 -0.0157 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9398 -2.5956 -1.2156 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.1721 0.0261 0.4576 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.0143 -0.9617 -1.0681 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0238 -1.4232 -2.2163 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4116 -0.3420 -2.0957 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4775 1.8882 1.4907 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0838 -2.1795 0.0951 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1542 -2.1975 -0.9141 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0070 -0.7873 0.0806 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3943 -2.0525 -1.0062 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9923 -2.0866 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0
1 4 2 0 0 0 0
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1 8 1 0 0 0 0
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2 15 1 0 0 0 0
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27 47 1 0 0 0 0
27 48 1 0 0 0 0
27 49 1 0 0 0 0
M END
$$$$