%chk=000179201.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179201

0 1
O -2.820827 0.329466 0.683462
N 2.242697 0.589236 -0.802697
C 4.207351 -0.777539 -0.008612
C 3.664055 0.279154 -1.026162
C 5.667667 -1.082780 -0.396898
C 3.373018 -2.063987 -0.086122
C 4.166656 -0.206570 1.418460
C 1.907923 1.635658 -0.123669
C 0.466626 1.938035 0.083388
C -0.470361 0.906420 0.229012
C 0.059107 3.281071 0.151702
C -1.808866 1.254730 0.433299
C -1.287452 3.596047 0.362626
C -2.241389 2.588080 0.505295
C -2.772222 -0.939564 0.101704
C -2.254077 -1.190800 -1.172736
C -3.391918 -1.931636 0.877422
C -2.360456 -2.489500 -1.678866
C -3.489518 -3.216440 0.342971
C -2.973314 -3.498477 -0.928533
H 3.722994 -0.146234 -2.055937
H 4.325275 1.171385 -1.016105
H 5.742491 -1.479852 -1.414248
H 6.101905 -1.833547 0.272645
H 6.301548 -0.193059 -0.338467
H 3.401258 -2.504257 -1.088105
H 3.728036 -2.818929 0.621091
H 2.316848 -1.866451 0.139867
H 4.714841 0.736222 1.497660
H 4.612344 -0.904518 2.135681
H 3.137689 -0.025484 1.749604
H 2.592860 2.367395 0.335406
H -0.153221 -0.136180 0.177977
H 0.786815 4.080533 0.034418
H -1.597090 4.640277 0.413014
H -3.292915 2.810371 0.671001
H -1.786849 -0.400355 -1.756843
H -3.783620 -1.686681 1.861659
H -1.962712 -2.712535 -2.669026
H -3.968204 -4.005778 0.922215
H -3.050795 -4.504926 -1.333153


%chk=000179201-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179201

0 1
O -2.875644 0.351056 0.713036
N 2.244772 0.432430 -0.568373
C 4.328571 -0.825023 0.076695
C 3.659298 0.195586 -0.900446
C 5.814635 -0.974466 -0.340003
C 3.611572 -2.195714 -0.023677
C 4.240779 -0.287003 1.526807
C 1.831253 1.656317 -0.392623
C 0.427877 1.984832 -0.056220
C -0.535155 0.955256 0.119612
C 0.047470 3.343856 0.100864
C -1.861806 1.301099 0.440200
C -1.285924 3.670979 0.433863
C -2.247998 2.654469 0.603429
C -2.879154 -0.933194 0.108318
C -2.487664 -1.153563 -1.232770
C -3.406290 -1.980004 0.895762
C -2.616530 -2.450438 -1.777951
C -3.534236 -3.269454 0.334788
C -3.136739 -3.512144 -1.001227
H 3.692911 -0.241345 -1.920015
H 4.262337 1.137081 -0.908493
H 5.905656 -1.315036 -1.389306
H 6.321833 -1.718713 0.301684
H 6.359447 -0.015755 -0.242076
H 3.725868 -2.630003 -1.035645
H 4.036634 -2.911755 0.704508
H 2.532398 -2.082286 0.176982
H 4.706485 0.714211 1.611724
H 4.765975 -0.965190 2.224662
H 3.188596 -0.204916 1.852959
H 2.517314 2.529835 -0.486600
H -0.211666 -0.084038 0.009477
H 0.793522 4.135890 -0.035397
H -1.579873 4.718545 0.558672
H -3.286638 2.880957 0.861786
H -2.098207 -0.331450 -1.840831
H -3.707723 -1.768487 1.926028
H -2.314159 -2.626422 -2.816215
H -3.941867 -4.083875 0.943712
H -3.233732 -4.514120 -1.432303


