%chk=000149258.chk %nprocshared=4 %mem=7GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000149258 1 1 N -0.8095000 1.733000 1.9999999E-04 C -0.5473000 -0.6905000 3.0000001E-04 C 0.8770000 -0.5283000 3.9999999E-04 C -1.371800 0.4638000 1.9999999E-04 C 1.416300 0.7787000 3.0000001E-04 C 0.5604000 1.877600 3.9999999E-04 C -1.216000 -1.939000 3.9999999E-04 C -2.771700 0.3649000 -3.0000001E-04 C 1.803000 -1.601200 9.9999997E-05 C 2.805600 0.9829000 -9.9999997E-05 C -1.614900 2.954400 -3.9999999E-04 C -2.611900 -2.032100 -9.9999997E-05 C -3.388700 -0.8811000 -5.0000002E-04 C 3.184100 -1.388000 -3.9999999E-04 C 3.685500 -9.4999999E-02 -3.9999999E-04 H 0.9295000 2.897800 1.9999999E-04 H -0.6607000 -2.873500 6.0000003E-04 H -3.420300 1.234900 -3.9999999E-04 H 1.464900 -2.634300 0.000000 H 3.217500 1.990500 -1.9999999E-04 H -0.9736000 3.839700 -1.9999999E-04 H -2.225400 2.966300 -0.9071000 H -2.226200 2.966700 0.9059000 H -3.088100 -3.008500 -9.9999997E-05 H -4.472100 -0.9542000 -8.9999998E-04 H 3.863200 -2.235600 -6.9999998E-04 H 4.757700 7.5900003E-02 -7.9999998E-04 %chk=000149258-Freq.chk %nprocshared=4 %mem=7GB #p freq=noraman PBEPBE/SDD 000149258 1 1 N -0.784402 1.767156 -0.000173 C -0.563391 -0.690276 -0.000081 C 0.889502 -0.547774 -0.000085 C -1.400532 0.483864 -0.000145 C 1.441582 0.787699 -0.000120 C 0.559234 1.899869 -0.000156 C -1.210293 -1.961708 -0.000036 C -2.818095 0.368415 -0.000188 C 1.799546 -1.642114 -0.000066 C 2.858781 1.000131 -0.000126 C -1.635037 2.992597 -0.000240 C -2.605655 -2.070193 -0.000067 C -3.413371 -0.899610 -0.000152 C 3.185082 -1.418383 -0.000074 C 3.723230 -0.095664 -0.000097 H 0.953499 2.919789 -0.000189 H -0.609382 -2.874496 0.000021 H -3.456282 1.254130 -0.000265 H 1.432589 -2.671346 -0.000057 H 3.251773 2.022826 -0.000151 H -0.987787 3.880974 -0.000200 H -2.268876 3.012847 -0.901366 H -2.268991 3.012856 0.900802 H -3.077038 -3.057332 -0.000033 H -4.503963 -0.986177 -0.000191 H 3.867858 -2.274187 -0.000063 H 4.806919 0.051906 -0.000101