%chk=000112903.chk %nprocshared=8 %mem=21GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000112903 0 1 Cl -6.509400 2.3600001E-02 0.5174000 Cl -4.577900 1.650400 -1.568500 Cl -4.620800 -1.624700 -1.591000 Si -4.703700 6.0999999E-03 -0.3959000 O 0.9041000 2.310600 0.6550000 O 0.9207000 -2.322500 0.6341000 N 0.5168000 -7.3000002E-03 0.8120000 C -0.8244000 -1.3300000E-02 1.361400 C -1.901200 -3.5300002E-02 0.2797000 C -3.320100 -2.0700000E-02 0.8645000 C 2.514000 0.6955000 7.7000000E-03 C 2.517900 -0.6916000 1.9000000E-03 C 1.222200 1.142900 0.5266000 C 1.228400 -1.151000 0.5172000 C 3.598100 1.430400 -0.4261000 C 3.606100 -1.416800 -0.4381000 C 4.712600 0.7168000 -0.8759000 C 4.716500 -0.6931000 -0.8820000 H -0.9459000 0.8802000 1.984400 H -0.9300000 -0.8960000 2.002600 H -1.761400 -0.9250000 -0.3482000 H -1.757200 0.8289000 -0.3820000 H -3.449400 -0.9006000 1.506200 H -3.428600 0.8567000 1.513400 H 3.595200 2.514000 -0.4221000 H 3.609400 -2.500400 -0.4433000 H 5.589800 1.254200 -1.226800 H 5.596700 -1.222600 -1.237600 %chk=000112903-Freq.chk %nprocshared=4 %mem=3GB #p freq=noraman PBEPBE/SDD 000112903 0 1 Cl -6.671886 -0.025444 0.617451 Cl -4.628615 1.747925 -1.658994 Cl -4.615458 -1.780985 -1.661138 Si -4.743277 -0.017793 -0.390684 O 0.835431 2.354560 0.741884 O 0.816967 -2.353221 0.690470 N 0.508046 0.000427 0.841602 C -0.854243 -0.000534 1.384064 C -1.924895 -0.009127 0.263705 C -3.344650 -0.012634 0.878800 C 2.564034 0.710243 0.008601 C 2.558494 -0.706833 -0.006929 C 1.250698 1.184976 0.550564 C 1.241386 -1.182973 0.524481 C 3.674996 1.442546 -0.434852 C 3.663735 -1.437905 -0.466400 C 4.798347 0.711879 -0.903381 C 4.792783 -0.705962 -0.918947 H -0.964593 0.903635 2.009630 H -0.961560 -0.898143 2.019616 H -1.777701 -0.904738 -0.368218 H -1.785038 0.882850 -0.375135 H -3.491955 -0.904352 1.519274 H -3.497273 0.879480 1.517481 H 3.668417 2.536790 -0.417597 H 3.648555 -2.532180 -0.473196 H 5.683776 1.249274 -1.259084 H 5.673979 -1.242360 -1.286469