%chk=000230496.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230496

0 1
N 1.742250 0.179753 -0.135443
N -0.201556 -1.092514 -0.167994
N 2.597308 -2.361605 2.006101
C 2.525013 -1.088555 -0.300031
C 0.317670 0.099616 -0.084848
C -0.414406 1.393781 0.064421
C 2.428331 1.405141 0.042961
C 3.939254 -0.839138 -0.762096
C 3.754234 1.515831 -0.209279
C 4.510142 0.374687 -0.694951
C -0.969930 1.729556 1.305929
C -0.580487 2.238181 -1.042528
C -1.595303 -1.385506 -0.172141
C 2.565243 -1.802932 0.997268
C -1.691793 2.919512 1.438568
C -1.304995 3.424184 -0.901763
C -1.859470 3.765113 0.337342
C -2.500064 -0.773885 -1.059279
C -2.027020 -2.410782 0.693918
C -3.832218 -1.193618 -1.075223
C -3.362264 -2.810931 0.665881
C -4.267132 -2.205917 -0.215065
H 1.980891 -1.746684 -1.049168
H 1.823246 2.257778 0.373226
H 4.458550 -1.720908 -1.128836
H 4.278176 2.456156 -0.063996
H 5.538371 0.550258 -1.011896
H -0.844701 1.063364 2.161028
H -0.146646 1.969127 -2.005840
H -2.127538 3.184259 2.401765
H -1.439800 4.083352 -1.758673
H -2.425350 4.690501 0.443305
H -2.165137 0.011841 -1.731357
H -1.314894 -2.885066 1.369286
H -4.535331 -0.726051 -1.763291
H -3.702017 -3.602268 1.333458
H -5.306227 -2.526131 -0.231060


%chk=000230496-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000230496

0 1
N 1.751837 0.207359 -0.101471
N -0.176959 -1.073738 0.062056
N 2.955070 -2.389045 1.973178
C 2.480377 -1.075647 -0.329025
C 0.340076 0.132877 0.015202
C -0.410230 1.431745 0.092482
C 2.503549 1.365167 0.182438
C 3.799103 -0.829988 -1.055994
C 3.828216 1.456485 -0.169340
C 4.445115 0.367535 -0.919222
C -1.340085 1.643158 1.142941
C -0.244322 2.432734 -0.901640
C -1.555750 -1.395787 -0.009905
C 2.716946 -1.798021 0.964372
C -2.086262 2.839437 1.202181
C -1.002303 3.622434 -0.847754
C -1.923013 3.830420 0.205972
C -2.453790 -0.817206 -0.952705
C -2.026838 -2.430845 0.844942
C -3.793483 -1.255139 -1.016770
C -3.372630 -2.847693 0.787350
C -4.265184 -2.263288 -0.143164
H 1.798605 -1.722949 -0.911098
H 1.963438 2.181146 0.665544
H 4.213323 -1.664171 -1.629354
H 4.387195 2.363577 0.070745
H 5.416563 0.528923 -1.399292
H -1.476208 0.870230 1.906648
H 0.467713 2.273901 -1.719712
H -2.797280 2.994928 2.020562
H -0.874293 4.384360 -1.624360
H -2.508278 4.755525 0.249812
H -2.095818 -0.043122 -1.639769
H -1.319755 -2.891960 1.542251
H -4.471056 -0.807674 -1.753161
H -3.722053 -3.638882 1.460363
H -5.307136 -2.597285 -0.195603


