%chk=000184185.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184185

0 1
O 0.184603 0.903682 -1.260158
O -4.344600 0.766449 -0.281627
O -1.475236 -2.435476 1.628350
O 1.974778 -0.351841 2.376593
O 0.778253 1.439499 1.787398
N -2.050960 0.871170 -0.802718
N -0.562635 -0.807520 0.193636
C 1.508637 0.442217 -1.096698
C 2.177456 0.312452 0.129708
C 2.153795 0.240799 -2.326250
C 3.534992 -0.063015 0.099533
C -0.833305 0.292990 -0.578222
C 3.503866 -0.104186 -2.324525
C 4.192332 -0.262602 -1.112973
C -3.099659 0.268074 -0.138091
C -1.650758 -1.362189 0.829890
C -2.955382 -0.858788 0.692038
C 1.535929 0.568078 1.435414
C -4.507735 1.954078 -1.123185
C -0.118244 -2.974110 1.747962
H 1.592456 0.360409 -3.253636
H 4.066431 -0.196689 1.046530
H 4.024358 -0.259464 -3.271318
H 5.244485 -0.545453 -1.120521
H -3.801831 -1.306348 1.202099
H -3.915750 2.781031 -0.716121
H -5.585313 2.129561 -1.035822
H -4.202718 1.725055 -2.149241
H 0.577470 -2.192250 2.080389
H 0.194470 -3.382795 0.782261
H -0.263891 -3.753226 2.503318
H 1.587404 -0.168890 3.275387


%chk=000184185-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000184185

0 1
O 0.162727 0.819235 -1.242073
O -4.371722 0.812632 -0.155723
O -1.562795 -2.762771 1.312071
O 2.413380 0.921013 2.537078
O 0.386545 1.438148 1.546865
N -2.073011 0.832567 -0.698313
N -0.649382 -0.985969 0.044450
C 1.495291 0.380571 -1.051858
C 2.189403 0.458500 0.192025
C 2.160076 -0.037358 -2.222396
C 3.557609 0.069806 0.219888
C -0.894365 0.189389 -0.577680
C 3.519022 -0.409652 -2.172215
C 4.219524 -0.364312 -0.943685
C -3.129356 0.220531 -0.089534
C -1.728635 -1.566425 0.645631
C -3.020872 -1.000779 0.614972
C 1.545745 0.975854 1.426355
C -4.459288 2.106471 -0.872177
C -0.199868 -3.338400 1.330896
H 1.592396 -0.065755 -3.156829
H 4.088076 0.128324 1.173509
H 4.025699 -0.736265 -3.086644
H 5.273561 -0.655808 -0.897294
H -3.874924 -1.469591 1.100733
H -3.791906 2.850333 -0.406819
H -5.515233 2.396438 -0.773240
H -4.175371 1.982179 -1.930344
H 0.508858 -2.644881 1.814028
H 0.146738 -3.548810 0.305213
H -0.307005 -4.265645 1.912007
H 1.932782 1.301131 3.320502


