%chk=000115719.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000115719

0 1
Cl 0.669873 2.381485 1.408102
O 4.396440 0.071456 -1.231504
O -3.610143 -0.723370 -1.107238
N 1.976256 -0.028668 0.268675
C 0.802832 -0.621045 0.994701
C 0.749276 -2.167624 0.917722
C -0.452423 0.077392 0.492262
C -0.675047 -2.717139 0.991824
C -1.523271 -2.127331 -0.139717
C -1.521277 -0.629073 -0.069139
C 1.978670 -0.333200 -1.197685
C 3.279162 -0.435378 0.887319
C 3.141985 0.431072 -1.848530
C 4.403757 0.344092 0.184944
C -0.567500 1.478853 0.616117
C -2.643612 0.094470 -0.554308
C -1.671663 2.179764 0.139093
C -2.725325 1.484973 -0.466093
C -4.827748 -0.100472 -1.581632
H 0.919864 -0.333012 2.079226
H 1.361907 -2.592973 1.733970
H 1.222601 -2.517592 -0.023336
H -1.131126 -2.473380 1.971575
H -0.662926 -3.821092 0.925546
H -2.564753 -2.512368 -0.084557
H -1.140459 -2.453206 -1.129235
H 2.067369 -1.420644 -1.413945
H 1.012765 0.010098 -1.628693
H 3.255736 -0.171136 1.965787
H 3.477752 -1.525623 0.812856
H 3.301050 0.135799 -2.899553
H 3.005321 1.524511 -1.769847
H 4.304074 1.432998 0.342122
H 5.406176 -0.001330 0.489644
H -1.721403 3.264827 0.237223
H -3.581626 2.032472 -0.845478
H -5.346840 0.399406 -0.758890
H -5.398121 -0.968739 -1.936776
H -4.608003 0.586125 -2.404152


%chk=000115719-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115719

0 1
Cl 0.719556 2.408586 1.585462
O 4.421582 0.185175 -1.304680
O -3.637329 -0.710346 -1.170098
N 2.003630 -0.165374 0.226464
C 0.838520 -0.687145 1.000866
C 0.731264 -2.247547 0.981077
C -0.433407 0.037884 0.536836
C -0.718674 -2.758020 1.074963
C -1.539380 -2.180380 -0.096520
C -1.517958 -0.659161 -0.063391
C 2.019121 -0.441008 -1.224745
C 3.323102 -0.404452 0.845938
C 3.093265 0.436676 -1.892129
C 4.381602 0.464758 0.142046
C -0.551886 1.445682 0.681500
C -2.632936 0.072599 -0.569117
C -1.652455 2.166234 0.196035
C -2.700536 1.478381 -0.454690
C -4.821853 -0.017474 -1.680677
H 1.023782 -0.362493 2.045650
H 1.349180 -2.664484 1.797832
H 1.162899 -2.625239 0.033344
H -1.177406 -2.448306 2.034994
H -0.734652 -3.864329 1.045334
H -2.588144 -2.522146 -0.064404
H -1.125080 -2.554043 -1.056344
H 2.246183 -1.511352 -1.460948
H 1.028636 -0.198946 -1.652997
H 3.275053 -0.124498 1.916084
H 3.639568 -1.475947 0.782064
H 3.197467 0.197756 -2.963817
H 2.824624 1.507139 -1.765334
H 4.143889 1.537231 0.307949
H 5.396375 0.241521 0.512280
H -1.699151 3.250819 0.327324
H -3.552562 2.044589 -0.840398
H -5.356131 0.518440 -0.871986
H -5.465106 -0.811042 -2.088498
H -4.555051 0.695660 -2.484869


