%chk=000296796.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296796

0 1
O 2.935453 -3.170577 -0.096094
O 0.824492 -2.729024 -0.133189
O 5.701006 2.328674 0.085702
O 6.271319 0.241510 0.034082
N -0.993818 0.708344 -0.115415
N -0.041261 -0.295077 -0.157293
N 2.011178 -2.380440 -0.105992
N 5.442034 1.136646 0.044978
C -2.883513 -0.949227 -0.361930
C -2.265125 0.414631 -0.198211
C -2.785538 -1.795640 0.920137
C -3.192445 1.577696 -0.142346
C 1.288079 0.058255 -0.086009
C -3.036106 -3.241874 0.605837
C -4.216693 1.598746 0.817570
C -3.050020 2.640797 -1.046109
C 2.303549 -0.959022 -0.080683
C 1.703501 1.432553 -0.026005
C 3.666772 -0.586040 -0.039550
C 4.026307 0.751470 0.005376
C 3.027592 1.772150 0.017323
C -5.097662 2.681264 0.865109
C -3.939714 3.717990 -0.994018
C -4.962358 3.739343 -0.041010
C -2.052327 -4.134649 0.454257
C -2.286061 -5.573240 0.145004
H -2.404057 -1.485802 -1.210834
H -3.949043 -0.861690 -0.665554
H -1.799848 -1.664674 1.410975
H -3.525059 -1.437543 1.665925
H -4.085022 -3.514061 0.503615
H -4.320637 0.778472 1.526636
H -2.245777 2.628795 -1.781795
H -0.313887 -1.310683 -0.203244
H 0.927663 2.208087 -0.013144
H 4.442583 -1.374136 -0.042083
H 3.351173 2.821118 0.061500
H -5.891364 2.702200 1.611174
H -3.831846 4.543660 -1.696751
H -5.653139 4.580856 -0.001602
H -0.995779 -3.858123 0.548473
H -1.768342 -5.864343 -0.781252
H -3.346476 -5.825769 0.020107
H -1.890185 -6.214820 0.946533


%chk=000296796-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296796

0 1
O 3.025929 -3.159833 -0.144541
O 0.805147 -2.648316 -0.155194
O 5.866278 2.438422 -0.197314
O 6.433414 0.223684 -0.188953
N -0.921256 0.836800 -0.184592
N 0.036834 -0.164795 -0.226405
N 2.076176 -2.291453 -0.164169
N 5.563107 1.179575 -0.193322
C -2.635265 -0.987365 -0.422660
C -2.198145 0.461499 -0.264853
C -2.689547 -1.773388 0.936189
C -3.201634 1.553191 -0.162243
C 1.374733 0.155265 -0.207487
C -3.110018 -3.213913 0.723383
C -4.590116 1.269023 -0.025884
C -2.791809 2.919777 -0.184044
C 2.397868 -0.868309 -0.190109
C 1.803846 1.523994 -0.205660
C 3.768862 -0.527711 -0.187632
C 4.133830 0.822436 -0.194276
C 3.154168 1.857391 -0.199463
C -5.534687 2.312188 0.081724
C -3.735310 3.957785 -0.081543
C -5.114396 3.660500 0.051681
C -2.256350 -4.271644 0.753189
C -2.649285 -5.711899 0.520156
H -1.950859 -1.527644 -1.105694
H -3.625568 -1.035793 -0.904193
H -1.698661 -1.743074 1.426996
H -3.397371 -1.256415 1.613301
H -4.175418 -3.387904 0.503529
H -4.944726 0.233963 0.007496
H -1.726354 3.142981 -0.285580
H -0.170978 -1.184318 -0.231131
H 1.027903 2.290962 -0.210139
H 4.527136 -1.314718 -0.177438
H 3.485729 2.898949 -0.199927
H -6.597833 2.071806 0.189806
H -3.400933 5.000694 -0.107316
H -5.848729 4.469540 0.130211
H -1.189812 -4.084341 0.954111
H -2.094316 -6.138513 -0.337851
H -3.730480 -5.813914 0.319038
H -2.401503 -6.338364 1.399004


