%NProcShared=64 %Mem=54Gb #B3LYP/6-31G(d,p) SCF=Tight Pop=(ESP,Dipole,Regular) Iop(6/33=2) Iop(6/42=6) Iop(6/50=1) gfinput partial charges -1 1 Cl -3.75892683947868 -0.96072855693198 -3.46085592443162 Cl 3.64826774773688 4.97969535765305 -2.41704290965858 Cl 5.85994592898943 0.08766458160903 -0.99378137700841 S -3.38590451218958 -6.08328962538338 5.61034387413360 O -1.19122611811375 6.41475948372732 -3.34152671531732 O 3.49294102994562 5.02085733664629 0.56995935182741 O -0.71266694684831 4.02511369351958 -2.04969325815368 O -4.40691432120323 7.21234488292298 -1.94460621613466 O -0.06923090863765 1.37949539963725 -2.44981621306372 O 5.61561161559913 1.03734314964402 1.89713891709522 O -6.00329147238804 0.88905020714271 -3.53467592178017 O -7.61516167787061 1.83645211257009 -0.59705490717691 O 2.96062608900120 -1.64170122965074 -1.38624519881427 O 2.77786353213114 -2.42368015932921 1.79501312945065 O -1.59972943053105 -4.66440833172378 3.23339087796803 O -3.41851466694480 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