%chk=000205507.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205507

0 1
N -0.841925 1.027903 1.429584
C -1.056097 -0.396274 1.815866
C 0.548198 1.521399 1.650076
C -1.364981 1.362905 0.067812
C -0.740730 -1.462198 0.790223
C 1.554818 1.296673 0.544466
C 1.762871 -1.169264 1.127062
C 0.578296 -1.847925 0.489147
C 2.145734 0.040870 0.314693
C -2.897375 1.486171 0.133192
C -3.466126 1.975798 -1.204878
C -1.806598 -2.106360 0.141551
C 1.929409 2.387322 -0.256511
C 0.807885 -2.872540 -0.443696
C 3.099366 -0.102180 -0.706430
C -1.572237 -3.123150 -0.785663
C 2.877513 2.238656 -1.270210
C -0.260302 -3.509222 -1.077062
C 3.465211 0.989830 -1.494697
C -4.987843 2.096528 -1.158991
H -2.133605 -0.461828 2.107365
H -0.489586 -0.603078 2.752894
H 0.936751 1.090231 2.601421
H 0.442723 2.616568 1.849702
H -1.066523 0.617823 -0.701779
H -0.929067 2.333994 -0.253789
H 1.537322 -0.885387 2.177815
H 2.619027 -1.871793 1.209062
H -3.179601 2.180851 0.948855
H -3.348405 0.513022 0.402724
H -3.170698 1.282252 -2.016782
H -3.022723 2.956211 -1.467903
H -2.831297 -1.807762 0.361412
H 1.476269 3.363364 -0.085853
H 1.828105 -3.168924 -0.680291
H 3.552956 -1.074591 -0.889467
H -2.408231 -3.612782 -1.280459
H 3.158075 3.092222 -1.883586
H -0.071889 -4.302142 -1.798109
H 4.204932 0.868597 -2.283600
H -5.385791 2.452726 -2.115613
H -5.462956 1.132859 -0.943728
H -5.312677 2.801326 -0.384924


%chk=000205507-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000205507

0 1
N -0.798018 1.016775 1.335653
C -1.085811 -0.372460 1.761612
C 0.557137 1.560246 1.589146
C -1.424471 1.466646 0.074035
C -0.756123 -1.507864 0.777990
C 1.634438 1.319375 0.520058
C 1.790328 -1.192600 1.104210
C 0.583955 -1.904498 0.486672
C 2.225789 0.038657 0.305937
C -2.968033 1.492557 0.127564
C -3.581591 2.107585 -1.151777
C -1.823673 -2.201431 0.152909
C 2.062230 2.411765 -0.275984
C 0.805877 -2.976274 -0.413253
C 3.225542 -0.101959 -0.688148
C -1.593320 -3.262257 -0.750689
C 3.051816 2.261024 -1.272527
C -0.266601 -3.653387 -1.035009
C 3.639989 0.993573 -1.477977
C -5.125582 2.100340 -1.137684
H -2.165024 -0.438716 1.998614
H -0.550980 -0.533513 2.717812
H 0.893852 1.161959 2.566294
H 0.453671 2.656854 1.716648
H -1.098875 0.856668 -0.802714
H -1.066591 2.498073 -0.116472
H 1.565204 -0.905552 2.148123
H 2.635407 -1.903931 1.145319
H -3.285318 2.069724 1.018632
H -3.366097 0.465698 0.251715
H -3.216536 1.548335 -2.037327
H -3.217047 3.148676 -1.269173
H -2.855180 -1.908265 0.388355
H 1.613781 3.399005 -0.103814
H 1.836477 -3.287536 -0.625445
H 3.687878 -1.085030 -0.842565
H -2.437224 -3.780174 -1.220139
H 3.363925 3.121534 -1.874981
H -0.068098 -4.479453 -1.727116
H 4.415308 0.859524 -2.240733
H -5.541730 2.543836 -2.061015
H -5.515302 1.068113 -1.053289
H -5.517179 2.677060 -0.278564


