%chk=000297006.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297006

0 1
O 3.848815 -1.532832 -1.562380
N 2.474077 0.246148 0.030985
N 3.853024 0.252938 -0.006198
N 5.862582 -0.639485 -0.907034
C -2.266873 -1.237700 0.266095
C -3.759562 -1.251932 0.688625
C -4.633788 -0.486228 -0.306251
C -1.837010 0.171679 -0.148860
C -4.201662 0.982811 -0.376007
C -2.706128 1.150667 -0.461353
C -2.049136 -2.187002 -0.928919
C -1.423522 -1.717371 1.463687
C -0.375292 0.348738 -0.242122
C -2.283426 2.514235 -0.919278
C 0.337085 1.090764 0.619299
C 1.802537 1.242964 0.546383
C 2.373801 2.518840 1.096756
C 4.439046 -0.722307 -0.885199
H -3.862316 -0.802868 1.694855
H -4.111171 -2.294657 0.784380
H -5.697857 -0.555990 -0.014908
H -4.559015 -0.949009 -1.309902
H -4.563212 1.524138 0.523826
H -4.692673 1.473730 -1.239589
H -2.592938 -1.842481 -1.814456
H -0.989457 -2.253351 -1.201464
H -2.387799 -3.201663 -0.700509
H -1.765706 -2.689029 1.830762
H -0.365654 -1.829551 1.192667
H -1.466782 -1.006105 2.294214
H 0.102266 -0.200406 -1.063768
H -2.602629 2.693419 -1.955422
H -1.195306 2.659042 -0.895161
H -2.726744 3.301163 -0.295984
H -0.138594 1.623748 1.443538
H 1.594174 3.269688 1.289667
H 2.886910 2.342720 2.053013
H 3.086092 2.987042 0.405150
H 4.369740 1.126329 0.160731
H 6.323256 -1.418480 -1.368869
H 6.363145 -0.320356 -0.091399


%chk=000297006-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297006

0 1
O 3.965290 -1.899767 -1.075457
N 2.463897 0.303062 -0.167504
N 3.845735 0.295477 -0.189955
N 5.916745 -0.694838 -0.649167
C -2.336118 -1.308520 0.246444
C -3.861300 -1.354810 0.552093
C -4.688774 -0.508819 -0.428949
C -1.860878 0.151835 -0.018835
C -4.262381 0.966948 -0.320120
C -2.750744 1.177455 -0.289757
C -2.021877 -2.195360 -0.997317
C -1.597270 -1.899247 1.483727
C -0.396768 0.302390 -0.022982
C -2.327105 2.603270 -0.604841
C 0.378837 1.380070 0.340044
C 1.850169 1.382894 0.305001
C 2.589339 2.615156 0.815373
C 4.525722 -0.850146 -0.671769
H -4.033831 -0.978185 1.581761
H -4.192906 -2.411849 0.537574
H -5.770319 -0.610109 -0.216417
H -4.530025 -0.865835 -1.464525
H -4.700551 1.414257 0.600571
H -4.687996 1.551311 -1.161064
H -2.579425 -1.853612 -1.887644
H -0.946782 -2.178370 -1.250459
H -2.299467 -3.247314 -0.794371
H -2.002559 -2.902462 1.718280
H -0.512032 -2.007404 1.312068
H -1.738572 -1.254382 2.370883
H 0.177115 -0.588235 -0.317293
H -3.061207 3.083043 -1.278795
H -1.332970 2.644412 -1.083077
H -2.278333 3.231128 0.308881
H -0.080625 2.292419 0.734628
H 1.878367 3.385233 1.152372
H 3.246192 2.373432 1.676271
H 3.221426 3.072358 0.026413
H 4.390060 1.101213 0.145797
H 6.464238 -1.486298 -0.976602
H 6.399980 0.150199 -0.351681


