%chk=000185577.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185577

0 1
O 3.172889 1.458752 -1.105396
N 4.056971 0.394335 0.706266
C -4.981213 -0.500145 0.048750
C -4.384639 0.534792 -0.914551
C -5.063881 -1.887883 -0.600689
C -4.291859 1.933620 -0.289751
C -5.665062 -2.923650 0.359873
C -3.156181 2.059737 0.736417
C 5.729909 -1.184400 -0.299475
C 5.398956 0.276898 0.092260
C -5.748231 -4.307049 -0.281483
C -1.798453 1.999605 0.108732
C 5.953594 -2.059182 0.938977
C 6.968456 -1.196473 -1.202257
C -0.724884 1.483293 0.727113
C 2.992322 0.965095 0.001101
C 0.596118 1.458582 0.104375
C 1.685105 0.951080 0.705765
H -5.988149 -0.175570 0.374036
H -4.368194 -0.551909 0.969456
H -3.380339 0.204203 -1.245835
H -5.001282 0.586136 -1.833250
H -5.670737 -1.837987 -1.525055
H -4.056165 -2.215393 -0.921677
H -5.252775 2.191564 0.197819
H -4.156969 2.685175 -1.092614
H -6.674570 -2.599117 0.679691
H -5.057327 -2.976788 1.284280
H -3.252266 3.026613 1.278479
H -3.271372 1.275733 1.514349
H 4.865365 -1.597889 -0.877990
H 5.434236 0.929197 -0.816131
H 6.153782 0.675292 0.803365
H -6.375237 -4.298390 -1.180305
H -6.177570 -5.039678 0.410882
H -4.759029 -4.675167 -0.576792
H -1.731376 2.421986 -0.897393
H 6.764079 -1.674774 1.567559
H 6.223974 -3.082667 0.653832
H 5.053296 -2.125105 1.557122
H 7.846964 -0.779524 -0.698499
H 6.803314 -0.614837 -2.117064
H 7.223632 -2.216682 -1.510019
H 3.917618 -0.091264 1.582337
H -0.795630 1.056912 1.729715
H 0.676526 1.882448 -0.908037
H 1.654182 0.526878 1.705514


%chk=000185577-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185577

0 1
O 3.082639 1.547110 -0.916509
N 3.714896 0.147030 0.838551
C -4.569607 -0.436073 0.051856
C -4.317739 0.628368 -1.040986
C -4.563137 -1.879642 -0.500589
C -4.436459 2.090408 -0.546655
C -4.779654 -2.953171 0.590447
C -3.397901 2.491296 0.543963
C 5.390880 -1.240990 -0.466107
C 5.108017 0.026312 0.387867
C -4.777803 -4.392163 0.030410
C -1.970551 2.397258 0.063619
C 5.114807 -2.540000 0.324606
C 6.848104 -1.199002 -0.980047
C -0.975370 1.670966 0.662287
C 2.774913 0.903980 0.141030
C 0.389252 1.612739 0.159910
C 1.409208 0.901394 0.734357
H -5.544589 -0.235429 0.544763
H -3.795875 -0.352367 0.842021
H -3.310431 0.468994 -1.476643
H -5.044193 0.474028 -1.865217
H -5.352627 -1.980503 -1.274775
H -3.598188 -2.070444 -1.015221
H -5.453924 2.260723 -0.139674
H -4.323706 2.776541 -1.410921
H -5.740912 -2.757361 1.108495
H -3.986653 -2.853723 1.359961
H -3.610380 3.540167 0.842373
H -3.534909 1.871682 1.450154
H 4.707532 -1.203323 -1.337915
H 5.323820 0.925799 -0.215714
H 5.774124 0.029934 1.274328
H -5.583268 -4.528134 -0.715905
H -4.929277 -5.140006 0.830612
H -3.817496 -4.620991 -0.469289
H -1.727149 2.963517 -0.850594
H 5.769225 -2.605381 1.216670
H 5.311268 -3.430737 -0.299949
H 4.062378 -2.596238 0.660106
H 7.566546 -1.214135 -0.136953
H 7.038272 -0.286059 -1.574254
H 7.065945 -2.072778 -1.621008
H 3.417926 -0.364845 1.670196
H -1.207149 1.097154 1.572887
H 0.634366 2.179429 -0.750947
H 1.232724 0.315070 1.648211


