%chk=000179405.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179405

0 1
O 2.623801 0.896042 -0.474927
O -2.773836 -0.033981 0.161162
N 6.032416 -0.254309 0.136306
C 4.940284 0.675976 -0.285510
C 6.459176 -1.136231 -1.001989
C 7.195126 0.478315 0.737073
C 3.618030 0.005737 0.119880
C 7.168782 -2.377816 -0.460173
C 6.820980 1.011532 2.120498
C 1.291256 0.603685 -0.271620
C 0.429052 1.536906 -0.876908
C 0.799638 -0.495195 0.451161
C -1.439514 0.272116 -0.038429
C -0.949750 1.370339 -0.760086
C -0.577986 -0.661000 0.569041
C -3.763107 0.890213 -0.382408
C -5.100041 0.296987 -0.029233
C -5.235252 -1.075331 0.219409
C -6.224059 1.135140 0.026888
C -6.491160 -1.607374 0.524272
C -7.477453 0.595314 0.326298
C -7.613277 -0.774682 0.575650
H 5.022613 1.660754 0.224317
H 4.929844 0.904642 -1.372939
H 5.549206 -1.453168 -1.559651
H 7.110786 -0.610207 -1.732760
H 8.037585 -0.243288 0.841044
H 7.563023 1.305197 0.092186
H 3.479064 -0.019393 1.212612
H 3.498648 -1.001909 -0.309641
H 8.139539 -2.135013 -0.013265
H 6.569434 -2.860349 0.324235
H 7.337973 -3.111728 -1.254580
H 6.067997 1.806118 2.067394
H 6.398343 0.213235 2.745909
H 7.698093 1.414554 2.636707
H 0.851170 2.375256 -1.427671
H 1.469260 -1.212276 0.917556
H -1.616628 2.088299 -1.227036
H -1.000777 -1.497408 1.122854
H -3.604717 1.880860 0.081690
H -3.627228 0.947754 -1.479279
H -4.352818 -1.717476 0.182118
H -6.125865 2.202204 -0.159965
H -6.593933 -2.673277 0.721357
H -8.350466 1.244434 0.367960
H -8.590753 -1.190898 0.810693


%chk=000179405-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179405

0 1
O 2.667612 1.079861 -0.431519
O -2.806774 -0.083345 0.304043
N 6.136336 -0.192304 0.101174
C 5.053699 0.752728 -0.270106
C 6.447853 -1.159565 -0.986710
C 7.340781 0.473082 0.664083
C 3.687535 0.155933 0.093454
C 7.036466 -2.485480 -0.467850
C 7.125424 0.979770 2.102771
C 1.317366 0.747403 -0.218569
C 0.369359 1.648747 -0.754872
C 0.873183 -0.404421 0.481717
C -1.454825 0.257247 0.092646
C -1.012108 1.411514 -0.603259
C -0.507848 -0.641927 0.632819
C -3.819833 0.805570 -0.270430
C -5.197985 0.226276 -0.002578
C -5.376211 -1.127384 0.369070
C -6.336094 1.055918 -0.164533
C -6.676814 -1.644298 0.569684
C -7.635203 0.537724 0.030282
C -7.810094 -0.817021 0.398183
H 5.179787 1.701626 0.279705
H 5.062632 1.008212 -1.354923
H 5.504076 -1.379141 -1.520671
H 7.138144 -0.709186 -1.744617
H 8.160047 -0.268430 0.672945
H 7.684677 1.316230 0.012593
H 3.595300 0.058052 1.193165
H 3.559712 -0.847161 -0.364073
H 7.993102 -2.332841 0.063860
H 6.331995 -2.966111 0.233176
H 7.229088 -3.177436 -1.309023
H 6.320049 1.734731 2.157292
H 6.849197 0.139517 2.763289
H 8.049154 1.448813 2.490360
H 0.730211 2.532842 -1.289421
H 1.585096 -1.115294 0.910434
H -1.721109 2.128446 -1.026804
H -0.868404 -1.524228 1.170519
H -3.732734 1.819215 0.175229
H -3.647590 0.897484 -1.365576
H -4.494182 -1.758542 0.507559
H -6.209294 2.110527 -0.442247
H -6.804261 -2.693227 0.860770
H -8.506866 1.189297 -0.098278
H -8.817153 -1.220122 0.553436


