%chk=000297176.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297176

0 1
O -0.339774 -0.274836 2.488612
N 2.216839 0.472349 1.103007
C 0.194429 0.022589 -0.148237
C -0.794289 -0.107161 1.201944
C -0.546423 1.318723 -0.404279
C -0.514362 -1.227182 -0.622261
C -1.375702 1.226456 0.762817
C -1.352692 -1.348394 0.538542
C 1.672487 0.065863 -0.081119
C -0.625779 2.373834 -1.271930
C -0.578147 -2.122418 -1.655150
C -2.292528 2.188566 1.081799
C -2.253128 -2.365640 0.688162
C 2.467553 -0.278727 -1.192994
C -1.576661 3.378286 -0.944042
C -1.513524 -3.182855 -1.506417
C -2.377427 3.291169 0.188082
C -2.317730 -3.301787 -0.380139
C 3.856234 -0.202299 -1.074956
C 3.570047 0.539245 1.198690
C 4.424206 0.212268 0.134010
H 0.450205 0.316394 2.657658
H -0.006737 2.461086 -2.158339
H 0.040259 -2.051088 -2.543029
H -2.923974 2.134093 1.963831
H -2.883107 -2.472639 1.566656
H 2.000124 -0.598724 -2.120889
H -1.669998 4.238380 -1.606427
H -1.591534 -3.919396 -2.305514
H -3.092225 4.083078 0.406965
H -3.019211 -4.131256 -0.301120
H 4.493703 -0.464189 -1.919671
H 3.965521 0.867634 2.167118
H 5.502443 0.279279 0.250321


%chk=000297176-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297176

0 1
O -0.056186 -0.262337 2.429683
N 2.176204 0.512501 1.101002
C 0.207655 0.012569 -0.231116
C -0.678066 -0.115427 1.161701
C -0.571695 1.337955 -0.450277
C -0.547962 -1.260079 -0.687949
C -1.325363 1.233934 0.744800
C -1.301412 -1.368127 0.509446
C 1.702236 0.054282 -0.108847
C -0.721518 2.403422 -1.346337
C -0.712423 -2.151241 -1.756865
C -2.266077 2.200941 1.121069
C -2.246796 -2.380320 0.711918
C 2.582911 -0.340942 -1.145599
C -1.675285 3.395259 -0.975877
C -1.668120 -3.189581 -1.563023
C -2.423773 3.298133 0.226292
C -2.411955 -3.303253 -0.360022
C 3.975854 -0.225532 -0.950469
C 3.523071 0.613168 1.282085
C 4.459546 0.268274 0.283400
H 0.850104 0.192703 2.315858
H -0.142253 2.496857 -2.271179
H -0.147786 -2.080043 -2.693154
H -2.841502 2.139691 2.050373
H -2.819861 -2.478736 1.639280
H 2.174185 -0.725125 -2.085153
H -1.834147 4.260267 -1.630489
H -1.834911 -3.922800 -2.360887
H -3.139741 4.092366 0.468740
H -3.131162 -4.124469 -0.258659
H 4.672571 -0.516258 -1.743939
H 3.851250 0.977458 2.261684
H 5.531508 0.375192 0.474210


