fragmenstein/demo/mpro_mols/Mpro-x11475.mol
RDKit 3D
20 22 0 0 0 0 0 0 0 0999 V2000
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8.4710 -1.9800 22.5760 C 0 0 0 0 0 0 0 0 0 0 0 0
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8.7220 0.0250 21.3400 C 0 0 0 0 0 0 0 0 0 0 0 0
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5.4780 0.7360 20.2850 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9630 0.9260 21.6890 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0690 -0.0980 18.6920 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4470 0.4830 17.6610 N 0 0 0 0 0 0 0 0 0 0 0 0
5.3370 1.1760 17.9350 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8250 1.3260 19.2090 C 0 0 0 0 0 0 0 0 0 0 0 0
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20 19 2 0
20 15 1 0
M END