%chk=000239113.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239113

0 1
Cl -0.341557 6.219915 -0.899297
N 5.017484 -1.931339 -0.544995
N -4.544557 -2.654010 -0.665835
C 0.005471 0.498950 0.971496
C 1.299032 -0.184634 0.573138
C -1.215523 -0.288722 0.537893
C -0.059964 1.933666 0.475974
C 2.469339 0.097546 1.295876
C -1.679353 -1.336306 1.348271
C 1.371709 -1.086313 -0.496842
C -1.892744 -0.013019 -0.658109
C 3.755214 -1.417930 -0.111605
C -3.485456 -1.803837 -0.217871
C -0.920500 2.833349 1.129855
C 0.705597 2.377925 -0.612353
C 3.679428 -0.506887 0.967785
C -2.797287 -2.082847 0.985647
C 2.575471 -1.700179 -0.836493
C -3.013180 -0.750424 -1.033553
C -1.013204 4.161414 0.709675
C 0.624510 3.705083 -1.043282
C -0.234874 4.576395 -0.373215
C 6.093584 -1.978761 0.484687
C 4.973297 -3.193757 -1.335624
C -5.273087 -3.405624 0.394820
C -5.492126 -2.055688 -1.648150
H -0.007790 0.541456 2.099217
H 2.436599 0.804149 2.125443
H -1.157194 -1.577031 2.274519
H 0.474531 -1.321071 -1.073593
H -1.543995 0.792196 -1.307248
H -1.528645 2.492162 1.967468
H 1.376175 1.686423 -1.127572
H 4.568072 -0.257722 1.542844
H -3.124178 -2.893405 1.632720
H 2.595378 -2.391167 -1.676266
H -3.511420 -0.511896 -1.970535
H -1.679005 4.859795 1.214734
H 1.222080 4.051633 -1.885703
H 6.265041 -0.963289 0.883593
H 7.037067 -2.298937 0.013471
H 5.875949 -2.653819 1.326598
H 5.986586 -3.436618 -1.694484
H 4.344688 -3.044338 -2.231399
H 4.583358 -4.057409 -0.775205
H -4.558284 -4.030241 0.959200
H -5.995204 -4.093349 -0.074562
H -5.813753 -2.762336 1.106008
H -4.933264 -1.718348 -2.539041
H -6.066166 -1.203767 -1.252229
H -6.200647 -2.827438 -1.990172


%chk=000239113-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000239113

0 1
Cl -0.184092 6.412779 -0.997497
N 4.943659 -2.203190 -0.334018
N -4.764481 -2.498906 -0.497261
C -0.022411 0.547996 0.992846
C 1.266739 -0.209936 0.633394
C -1.296939 -0.212007 0.588234
C -0.026462 2.001081 0.482746
C 2.449501 0.013945 1.383027
C -1.763895 -1.278207 1.397632
C 1.348640 -1.118634 -0.449052
C -2.023054 0.068145 -0.594505
C 3.744042 -1.549465 -0.019789
C -3.631907 -1.752737 -0.143395
C -0.872004 2.952826 1.111137
C 0.767537 2.428337 -0.609334
C 3.661256 -0.632217 1.076566
C -2.898853 -2.034761 1.054010
C 2.551119 -1.776599 -0.775923
C -3.163125 -0.676013 -0.959545
C -0.929113 4.292971 0.672610
C 0.724261 3.765907 -1.068781
C -0.125164 4.678028 -0.418230
C 6.147605 -1.951016 0.464172
C 4.990333 -3.148150 -1.454319
C -5.223757 -3.590081 0.367487
C -5.501591 -2.174935 -1.722670
H -0.042341 0.615809 2.101726
H 2.423526 0.715068 2.227797
H -1.220168 -1.528739 2.317960
H 0.449889 -1.330764 -1.039207
H -1.703298 0.892510 -1.242762
H -1.502533 2.639814 1.952261
H 1.438099 1.715753 -1.100843
H 4.541290 -0.426575 1.692660
H -3.215080 -2.842965 1.720037
H 2.557056 -2.473264 -1.619140
H -3.688705 -0.411144 -1.881673
H -1.580933 5.019844 1.166165
H 1.342283 4.088167 -1.912091
H 6.445902 -0.882422 0.436739
H 6.984689 -2.544520 0.063142
H 6.008309 -2.235696 1.528111
H 6.007134 -3.562946 -1.542816
H 4.737112 -2.660437 -2.418628
H 4.288612 -3.996074 -1.310529
H -4.449081 -4.375329 0.489459
H -6.113534 -4.062073 -0.078811
H -5.501903 -3.229744 1.379990
H -4.865712 -2.275318 -2.626666
H -5.902061 -1.139818 -1.704925
H -6.353689 -2.864702 -1.831797


