%chk=000112034.chk %nprocshared=4 %mem=3GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000112034 0 1 Cl -1.716000 -1.183800 1.139800 O -8.2300000E-02 1.641100 0.4246000 N 1.290800 -0.1502000 -9.4700001E-02 C -1.188900 -0.3360000 -0.3392000 C 4.6500001E-02 0.4758000 3.4200002E-02 C -2.324800 0.5522000 -0.8321000 C 2.544900 0.5271000 0.2238000 C 1.429700 -1.526200 -0.5566000 H -0.9756000 -1.079300 -1.110100 H -2.636400 1.281100 -7.5300001E-02 H -2.013000 1.114300 -1.719200 H -3.200400 -4.6799999E-02 -1.104800 H 3.035500 -5.1000002E-03 1.043900 H 2.366300 1.561800 0.5268000 H 3.185900 0.5184000 -0.6625000 H 0.6804000 -2.175700 -0.1010000 H 2.418700 -1.915200 -0.2953000 H 1.315000 -1.539200 -1.644300 %chk=000112034-Freq.chk %nprocshared=4 %mem=7GB #p freq=noraman PBEPBE/SDD 000112034 0 1 Cl -1.648920 -1.460232 1.011384 O -0.010525 1.708962 0.280002 N 1.289932 -0.182088 -0.132501 C -1.192599 -0.294595 -0.460098 C 0.075689 0.487428 -0.063457 C -2.380697 0.614228 -0.740286 C 2.524337 0.557944 0.188268 C 1.461513 -1.595731 -0.511299 H -1.009464 -1.004740 -1.281742 H -2.550050 1.297132 0.106087 H -2.163525 1.235924 -1.629295 H -3.288486 0.019094 -0.932690 H 3.015336 0.123876 1.080053 H 2.258145 1.605202 0.394394 H 3.231463 0.516360 -0.661942 H 0.552552 -2.180346 -0.305629 H 2.273843 -2.033245 0.096452 H 1.737755 -1.700874 -1.579701