File: RuleEvaluator_test.hin

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ball 1.5.0%2Bgit20180813.37fc53c-3
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file content (10 lines) | stat: -rw-r--r-- 464 bytes parent folder | download | duplicates (9) 
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forcefield mm+
sys 0
view 40 0.43353 55 15 0.05190092 0.3032888 0.9514842 0.303868 0.9027951 -0.3043441 -0.9512994 0.3049213 -0.04530386 -0.73959 -1.4907 -53.573
mol 1
atom 1 - F F - 0 -0.9406467 1.116006 2.877584e-07 1 2 s
atom 2 - C C4 - 0 -0.9406467 2.476007 2.877584e-07 4 1 s 3 s 4 s 5 s
atom 3 - H H - 0 0.08701652 2.839336 2.877584e-07 1 2 s
atom 4 - H H - 0 -1.45447 2.839336 -0.8899871 1 2 s
atom 5 - Cl Cl - 0 -1.454481 2.839344 0.8899779 1 2 s
endmol 1