%chk=000200809.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200809

0 1
O -0.373748 0.010581 1.783932
N -0.918947 0.043217 -0.438774
C 1.478304 -0.066712 0.247086
C 1.810976 -1.349094 -0.533810
C 1.924650 1.187181 -0.523308
C -2.410300 0.109244 -0.244638
C -0.010064 -0.001418 0.615947
C 1.442835 -2.614915 0.253227
C 1.671675 2.474204 0.274693
C -3.053822 0.143556 -1.644193
C -2.871358 -1.137695 0.525444
C -2.758353 1.386316 0.535345
C 1.840618 -3.881120 -0.500323
C 2.180941 3.705998 -0.468724
H 2.030887 -0.095534 1.225579
H 1.300271 -1.354179 -1.514675
H 2.895201 -1.359728 -0.764863
H 3.005419 1.102436 -0.755236
H 1.416295 1.246372 -1.503617
H -0.580523 0.031250 -1.394941
H 0.353790 -2.628782 0.463065
H 1.933534 -2.597998 1.247039
H 2.159283 2.405051 1.267761
H 0.588329 2.583757 0.485905
H -2.820096 -0.752575 -2.228184
H -4.146129 0.192265 -1.560149
H -2.740537 1.019652 -2.221291
H -2.391496 -1.176359 1.518038
H -2.610033 -2.063045 0.004661
H -3.952555 -1.132923 0.686048
H -2.415200 2.288657 0.021720
H -3.835702 1.476916 0.696308
H -2.277276 1.374204 1.528038
H 2.920687 -3.923581 -0.680953
H 1.340832 -3.948948 -1.472947
H 1.570105 -4.778269 0.069060
H 1.992194 4.618929 0.108497
H 3.260375 3.653038 -0.650360
H 1.688740 3.826555 -1.440110


%chk=000200809-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000200809

0 1
O -0.364001 -0.008365 1.923257
N -0.916020 0.050059 -0.344270
C 1.474885 -0.068089 0.279758
C 1.803627 -1.368375 -0.508191
C 1.916852 1.199973 -0.504809
C -2.406852 0.113749 -0.212443
C -0.010269 -0.005722 0.700575
C 1.467226 -2.669348 0.255116
C 1.689806 2.523646 0.259718
C -2.974950 0.162530 -1.651252
C -2.922859 -1.150893 0.523351
C -2.811739 1.393954 0.564770
C 1.840480 -3.937212 -0.542548
C 2.174906 3.756487 -0.532589
H 2.027739 -0.093174 1.238800
H 1.271056 -1.368421 -1.483694
H 2.886004 -1.359497 -0.753201
H 2.995616 1.099023 -0.744927
H 1.391372 1.245644 -1.483366
H -0.538882 0.049113 -1.294846
H 0.386425 -2.686724 0.497023
H 1.998643 -2.666844 1.227419
H 2.215273 2.473362 1.234125
H 0.613454 2.633383 0.498057
H -2.692361 -0.740748 -2.225104
H -4.076973 0.209909 -1.618222
H -2.613869 1.056831 -2.194272
H -2.477159 -1.211096 1.529585
H -2.657589 -2.064789 -0.039460
H -4.023005 -1.108788 0.622550
H -2.457901 2.298839 0.037269
H -3.912044 1.449808 0.654872
H -2.372264 1.377625 1.575297
H 2.923268 -3.961832 -0.769784
H 1.295585 -3.976419 -1.505137
H 1.593366 -4.854955 0.021760
H 2.009064 4.690367 0.034970
H 3.256101 3.685861 -0.757827
H 1.637790 3.847633 -1.496033


