# opt freq=noraman b3lyp/def2tzvpp pop=npa empiricaldispersion=gd3bj scf=(maxconventionalcycles=150,xqc) guess=mix Title -1 2 C -1.7756450 0.3083470 0.0565160 C -0.5026930 -0.2722720 0.0061460 C 0.6305440 0.5283520 0.0314910 C 0.5617300 1.9129650 0.1134920 C -0.7029990 2.4978380 0.1638190 C -1.8439960 1.7060020 0.1384740 H -0.4209750 -1.3498190 -0.0507100 H 1.4566050 2.5180800 0.1324880 H -0.7838870 3.5790730 0.2331520 H -2.8192700 2.1772070 0.1950100 B -3.1381430 -0.6038190 -0.0063150 F -3.7475240 -0.4733860 -1.3066780 F -4.0711990 -0.1385740 0.9956810 F -2.8093590 -1.9796310 0.2356680