%chk=000188654.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188654

0 1
Cl 5.698142 4.078392 0.365875
O 2.028456 -3.509267 0.095914
O 2.559671 -1.756308 1.413891
O -2.532646 -1.938078 -0.546547
N -0.692657 -0.643178 -0.994904
N 0.074378 0.424791 -0.565116
N -2.713834 0.354718 -0.136232
C 1.594820 -1.394154 -0.846466
C 0.156483 -1.877075 -1.200143
C 1.342381 0.097756 -0.514124
C 2.577379 -1.546479 -1.998987
C 2.123215 -2.163635 0.365883
C 2.417209 1.071183 -0.276651
C -2.052906 -0.818846 -0.514691
C 3.161673 1.047699 0.912263
C 2.682616 2.039504 -1.261616
C 4.181493 1.980496 1.115704
C 3.701289 2.973795 -1.066679
C 4.436212 2.927011 0.121157
C 2.475520 -4.418996 1.139428
C -4.093947 0.427165 0.245690
C -4.585985 1.700694 0.602733
C -4.934380 -0.697555 0.273922
C -5.920695 1.831082 0.985841
C -6.266681 -0.541049 0.660992
C -6.765024 0.715777 1.016970
H 0.061050 -2.186015 -2.262110
H -0.194356 -2.732538 -0.583650
H 2.226095 -1.022213 -2.898470
H 2.723049 -2.603363 -2.266024
H 3.563115 -1.128067 -1.748855
H 2.945760 0.294718 1.681259
H 2.087970 2.064793 -2.175674
H -2.192780 1.242137 -0.149170
H 4.765478 1.968943 2.036534
H 3.916425 3.727994 -1.823475
H 3.547508 -4.279722 1.309019
H 1.908591 -4.234706 2.057850
H 2.250088 -5.400371 0.707741
H -3.940214 2.575128 0.583704
H -4.554920 -1.686517 -0.003003
H -6.306359 2.812105 1.263043
H -6.921712 -1.412460 0.683985
H -7.804170 0.826713 1.316888


%chk=000188654-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188654

0 1
Cl 5.473919 3.973352 0.474187
O 3.486628 -2.902358 -0.034994
O 1.942023 -2.750831 1.691855
O -2.978576 -2.155951 -0.375206
N -0.907963 -1.113905 -0.291498
N -0.126453 0.018874 -0.111417
N -2.820063 0.204261 -0.084867
C 1.347124 -1.829009 -0.528040
C -0.115827 -2.367228 -0.339016
C 1.158322 -0.315664 -0.181852
C 1.815475 -1.989929 -1.999144
C 2.255632 -2.528072 0.502041
C 2.212283 0.696419 -0.025690
C -2.320507 -1.080330 -0.252829
C 3.593405 0.379576 -0.169566
C 1.858324 2.045075 0.280858
C 4.585677 1.371100 -0.018855
C 2.838608 3.040730 0.433403
C 4.196753 2.689577 0.279337
C 4.415677 -3.576884 0.909880
C -4.179504 0.608336 -0.020619
C -4.436783 1.995442 0.158430
C -5.266826 -0.300601 -0.125402
C -5.761930 2.469121 0.232100
C -6.587580 0.191574 -0.049785
C -6.848890 1.569669 0.128299
H -0.446835 -3.004518 -1.173225
H -0.231269 -2.919269 0.610331
H 1.076498 -1.515231 -2.668874
H 1.892736 -3.058883 -2.262229
H 2.796638 -1.525064 -2.179203
H 3.909519 -0.641448 -0.399571
H 0.802056 2.300555 0.402208
H -2.101590 0.930992 0.009077
H 5.643901 1.119497 -0.133334
H 2.556766 4.070643 0.670196
H 4.663728 -2.899699 1.744033
H 3.946711 -4.490257 1.310847
H 5.302909 -3.814387 0.307238
H -3.598360 2.699271 0.239885
H -5.065045 -1.364935 -0.261033
H -5.944388 3.540624 0.370812
H -7.421195 -0.515305 -0.130770
H -7.878928 1.937076 0.185703


