%chk=000115607.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000115607

0 1
O 0.352541 -2.227676 1.288719
O -0.295496 -2.936995 -1.671384
N 3.121495 1.472507 0.267491
N 0.742839 -0.034280 0.889606
C 3.262419 0.067470 0.797503
C 2.085348 1.263698 -0.806199
C 3.237005 -0.866719 -0.446501
C 2.467246 -0.064725 -1.517559
C 2.008022 -0.150306 1.685026
C 0.734254 1.126369 -0.044448
C 4.396822 2.041278 -0.246162
C -0.004195 -1.201351 0.713136
C -1.289988 -1.236108 -0.155192
C -0.804318 -1.604971 -1.583621
C -2.107323 0.042505 -0.106855
C -2.194825 -2.359907 0.380312
C -2.296131 0.692503 1.125951
C -2.736300 0.555845 -1.250292
C -3.080146 1.844476 1.204899
C -3.521157 1.710554 -1.167263
C -3.692884 2.359869 0.057426
H 4.182874 -0.056280 1.402509
H 2.036897 2.122615 -1.505404
H 2.744812 -1.827439 -0.220256
H 4.257143 -1.110307 -0.779135
H 3.090971 0.126438 -2.403815
H 1.573373 -0.610790 -1.877896
H 2.052221 -1.147127 2.181940
H 1.972066 0.625891 2.482196
H 0.565566 2.044794 0.568048
H -0.097846 1.063454 -0.771420
H 4.887399 1.453730 -1.035858
H 5.100413 2.146306 0.596048
H 4.203462 3.054313 -0.634624
H 0.001904 -0.919381 -1.931053
H -1.637054 -1.607820 -2.313865
H -1.676928 -3.331219 0.354743
H -3.107099 -2.454334 -0.218572
H -2.484990 -2.183369 1.422627
H -1.825160 0.298668 2.027812
H -2.633448 0.055439 -2.212666
H 0.190105 -3.188904 -0.846459
H -3.217087 2.341413 2.164701
H -4.003653 2.100145 -2.062668
H -4.303771 3.258128 0.120774


%chk=000115607-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115607

0 1
O 0.298933 -2.425992 1.234418
O -0.280445 -3.054309 -1.587457
N 3.108490 1.503609 0.316329
N 0.827286 -0.235487 0.691839
C 3.301288 0.094174 0.794083
C 2.123804 1.279395 -0.791541
C 3.460223 -0.772617 -0.505641
C 2.658596 0.032598 -1.582600
C 2.027470 -0.301932 1.573236
C 0.746813 0.994099 -0.136399
C 4.357750 2.174789 -0.111747
C -0.026651 -1.324350 0.657942
C -1.374818 -1.299908 -0.140286
C -1.022966 -1.795973 -1.584997
C -2.117419 0.046880 -0.118582
C -2.331765 -2.350139 0.511001
C -2.288883 0.723511 1.119005
C -2.726787 0.600313 -1.273802
C -3.031981 1.919285 1.199106
C -3.473388 1.799319 -1.196965
C -3.628657 2.466187 0.038354
H 4.169922 0.034139 1.472512
H 2.033304 2.187750 -1.412547
H 3.057121 -1.789878 -0.364759
H 4.524218 -0.868579 -0.784184
H 3.309069 0.353325 -2.415082
H 1.838875 -0.567531 -2.013746
H 2.093329 -1.329545 1.963352
H 1.891804 0.407004 2.412635
H 0.472435 1.858270 0.497887
H -0.022678 0.877883 -0.911262
H 4.918385 1.650600 -0.921962
H 5.029507 2.271975 0.759559
H 4.116838 3.192653 -0.466648
H -0.435180 -1.023664 -2.126290
H -1.957845 -1.980173 -2.147363
H -1.897885 -3.361196 0.471154
H -3.293790 -2.344549 -0.032350
H -2.525492 -2.103066 1.568053
H -1.833446 0.309947 2.027263
H -2.629504 0.103834 -2.245084
H 0.082787 -3.230994 -0.674806
H -3.147684 2.423969 2.165056
H -3.935856 2.208452 -2.102538
H -4.207729 3.394321 0.098152


