%chk=000117462.chk %nprocshared=4 %mem=3GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000117462 0 1 Cl -1.619000 2.422100 7.9999998E-04 S 2.295500 -0.9620000 3.9999999E-04 N 2.555900 0.6734000 -3.0000001E-04 C 0.2010000 0.4610000 -1.9999999E-04 C 0.5767000 -0.8841000 3.0000001E-04 C -1.176200 0.7741000 -6.9999998E-04 C -0.3651000 -1.924800 9.9999997E-05 C 1.374600 1.282100 -9.9999997E-05 C -2.123000 -0.2553000 -3.9999999E-04 C -1.720300 -1.586500 1.9999999E-04 H -5.5900000E-02 -2.965300 3.9999999E-04 H 1.390700 2.364000 -3.9999999E-04 H -3.185200 -2.3000000E-02 -3.0000001E-04 H -2.468400 -2.374900 3.9999999E-04 %chk=000117462-Freq.chk %nprocshared=4 %mem=3GB #p freq=noraman PBEPBE/SDD 000117462 0 1 Cl -1.677425 2.513112 -0.000306 S 2.403627 -1.060387 0.000035 N 2.597189 0.754028 0.000153 C 0.220002 0.447268 -0.000071 C 0.592105 -0.936488 0.000044 C -1.160835 0.762524 -0.000069 C -0.369013 -1.969143 0.000160 C 1.382768 1.315013 -0.000183 C -2.137346 -0.241081 0.000030 C -1.731533 -1.606005 0.000156 H -0.073745 -3.022226 0.000217 H 1.334068 2.407694 -0.000212 H -3.198259 0.021990 0.000014 H -2.500304 -2.385499 0.000232