%chk=000224612.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224612

0 1
Cl 5.376325 2.586110 -0.424070
N -4.082811 0.397560 -0.357428
N -0.608181 -0.428246 0.734859
N 3.182039 -2.010340 -0.320212
C -1.865037 -1.228890 0.725444
C -2.909993 -0.539264 1.622829
C -2.421261 -1.413754 -0.700901
C -3.510659 0.724177 0.988100
C -3.014436 -0.119674 -1.275114
C -4.764956 1.589238 -0.967324
C 0.618200 -0.953593 0.342594
C -6.070989 1.885589 -0.230002
C 1.746873 -0.056531 0.163545
C 0.822906 -2.325152 0.171749
C 3.006098 -0.641931 -0.165157
C 1.665121 1.360594 0.302344
C 2.116235 -2.800442 -0.150159
C 4.154756 0.197936 -0.351157
C 2.767853 2.159729 0.122992
C 4.010724 1.551209 -0.205496
H -1.627819 -2.239788 1.157984
H -2.474558 -0.293542 2.610187
H -3.727429 -1.265680 1.818918
H -3.211767 -2.192539 -0.672401
H -1.634177 -1.796225 -1.378423
H -2.754685 1.537405 0.952435
H -4.342012 1.092195 1.631055
H -3.486608 -0.341826 -2.258232
H -2.207801 0.619834 -1.466347
H -0.735989 0.580988 0.683697
H -4.121543 2.495244 -0.985775
H -4.998462 1.341698 -2.027927
H -6.660549 0.967466 -0.094660
H -5.899599 2.308213 0.765558
H -6.686020 2.595850 -0.792879
H 0.015340 -3.038269 0.292659
H 0.707067 1.815218 0.559232
H 2.284153 -3.878817 -0.277693
H 5.109095 -0.271456 -0.602203
H 2.712257 3.242003 0.228279


%chk=000224612-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224612

0 1
Cl 5.485369 2.701826 -0.238058
N -4.103846 0.347194 -0.346958
N -0.640376 -0.446145 0.660233
N 3.207836 -1.954580 -0.492240
C -1.870951 -1.253698 0.791394
C -2.895800 -0.492797 1.665204
C -2.519194 -1.573894 -0.584934
C -3.485973 0.736332 0.940060
C -3.110255 -0.310132 -1.237258
C -4.783136 1.476990 -1.035199
C 0.595813 -0.932604 0.278949
C -6.003560 2.020589 -0.270243
C 1.739680 -0.034255 0.167920
C 0.819086 -2.300207 -0.008547
C 3.013843 -0.603901 -0.221863
C 1.668422 1.371852 0.421173
C 2.118096 -2.743426 -0.375550
C 4.157605 0.251894 -0.342583
C 2.791286 2.197007 0.300268
C 4.029532 1.611522 -0.084647
H -1.603913 -2.201515 1.299797
H -2.428033 -0.183193 2.619429
H -3.725445 -1.182427 1.903540
H -3.328451 -2.312299 -0.427705
H -1.772664 -2.023999 -1.264655
H -2.691989 1.523199 0.787989
H -4.254120 1.193998 1.586583
H -3.619011 -0.585286 -2.179476
H -2.276734 0.391338 -1.507320
H -0.734044 0.552357 0.841080
H -4.066290 2.315100 -1.242272
H -5.119326 1.097959 -2.019209
H -6.695010 1.196918 -0.019376
H -5.721046 2.534326 0.666025
H -6.545321 2.753318 -0.895596
H 0.010686 -3.032595 0.047361
H 0.726402 1.847645 0.719348
H 2.275874 -3.807908 -0.589880
H 5.105196 -0.205020 -0.637949
H 2.727463 3.270812 0.496064


