%chk=000225643.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225643

0 1
N 0.802656 0.747885 -0.483679
C -3.888095 -0.506891 -1.792292
C -2.768653 -0.048598 -0.885513
C -3.283087 0.271285 0.411810
C -5.104498 -0.426009 -0.898565
C -4.732046 0.036842 0.403043
C -1.423749 0.078847 -1.171410
C -2.435729 0.720970 1.413202
C -6.422769 -0.728011 -1.191468
C -5.688247 0.191494 1.395740
C -0.566631 0.531380 -0.137397
C -1.064835 0.846042 1.137143
C -7.387066 -0.568595 -0.177829
C -7.026645 -0.117401 1.091395
C 4.228737 -0.366983 0.271556
C 3.177897 0.503348 -0.193274
C 5.569557 -0.073346 -0.093183
C 1.775389 0.221787 0.190856
C 3.485276 1.594511 -0.981342
C 3.979930 -1.520900 1.082041
C 5.850017 1.070044 -0.907354
C 6.626476 -0.927971 0.357054
C 4.831712 1.880529 -1.339790
C 5.010325 -2.325095 1.500046
C 6.354195 -2.025657 1.133424
H -3.719423 -1.533661 -2.168660
H -3.986989 0.144192 -2.682185
H -1.018224 -0.147130 -2.155227
H -2.819984 0.973052 2.399534
H -6.716153 -1.079705 -2.176686
H -5.415680 0.543361 2.387167
H -0.393166 1.208369 1.911862
H -8.428217 -0.802343 -0.394289
H -7.787664 -0.000416 1.860939
H 1.657603 -0.455329 1.057944
H 2.690830 2.253634 -1.345130
H 2.951984 -1.754019 1.363305
H 6.885024 1.279935 -1.175505
H 7.649156 -0.687570 0.068687
H 5.032718 2.751746 -1.962338
H 4.818566 -3.202834 2.115963
H 7.151901 -2.680991 1.479103


%chk=000225643-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225643

0 1
N 0.793859 0.537846 -0.690504
C -4.104366 0.108413 -1.919935
C -2.885582 0.169211 -1.005684
C -3.294952 0.038500 0.359318
C -5.258745 -0.068376 -0.938977
C -4.759932 -0.106189 0.400824
C -1.536171 0.339882 -1.335308
C -2.333086 0.084345 1.394184
C -6.636190 -0.187367 -1.191016
C -5.645854 -0.263320 1.490928
C -0.555127 0.349470 -0.299770
C -0.971600 0.235206 1.064019
C -7.524262 -0.345465 -0.096501
C -7.030903 -0.382715 1.232042
C 4.291424 -0.367096 0.340398
C 3.193443 0.273178 -0.364651
C 5.652199 -0.035798 -0.047898
C 1.787201 -0.000608 -0.018933
C 3.474007 1.186174 -1.401954
C 4.112847 -1.316577 1.403638
C 5.881251 0.899666 -1.108253
C 6.754821 -0.652107 0.633094
C 4.808092 1.498897 -1.775351
C 5.206252 -1.901420 2.047731
C 6.542249 -1.567877 1.663078
H -4.039755 -0.732916 -2.637609
H -4.212541 1.030494 -2.524228
H -1.197616 0.459575 -2.369542
H -2.636650 0.016369 2.444988
H -7.024533 -0.158999 -2.215743
H -5.272202 -0.293204 2.520767
H -0.223903 0.309190 1.862298
H -8.600929 -0.439507 -0.277393
H -7.731989 -0.505170 2.065354
H 1.592938 -0.695365 0.820315
H 2.623181 1.649217 -1.911650
H 3.105903 -1.601032 1.723092
H 6.914435 1.138072 -1.388058
H 7.773868 -0.388290 0.325631
H 4.991016 2.212554 -2.585723
H 5.040249 -2.623712 2.854663
H 7.390050 -2.033353 2.177015


