%chk=000200896.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200896

0 1
O 0.479081 -1.799847 1.530827
O 3.941418 1.449979 0.968823
N -3.008666 0.625962 0.237459
C -1.300160 -1.152113 -0.055562
C 0.199290 -1.517142 0.143263
C -2.195516 -2.333245 0.358129
C -1.679476 0.128903 0.722318
C 0.577771 -2.829264 -0.576080
C -1.833715 -3.600876 -0.425315
C -0.364572 -3.976447 -0.194606
C 1.123829 -0.391277 -0.329114
C -3.643463 1.571035 1.217437
C -2.888212 1.414452 -1.035213
C -3.306682 3.016124 0.786615
C -2.825488 2.915605 -0.672353
C 2.144167 0.063576 0.500077
C 0.958532 0.168524 -1.611571
C 2.987903 1.095723 0.039155
C 1.806880 1.184382 -2.047014
C 2.833766 1.669550 -1.227096
C 4.892630 2.478532 0.604936
H -1.458105 -0.967600 -1.148312
H -3.256405 -2.061013 0.190168
H -2.091073 -2.522566 1.443877
H -0.876960 0.892759 0.624007
H -1.761572 -0.106224 1.805495
H 1.618271 -3.095187 -0.298633
H 0.572632 -2.669148 -1.669620
H -2.025324 -3.450746 -1.504217
H -2.489571 -4.434702 -0.112719
H -0.209385 -4.224518 0.876517
H -0.103850 -4.883782 -0.768415
H -4.738560 1.390204 1.160575
H -3.338429 1.362704 2.257578
H -2.018734 1.097841 -1.639100
H -3.798241 1.191623 -1.631567
H -2.524893 3.450301 1.430971
H -4.186377 3.672633 0.877866
H -3.457006 3.513411 -1.348181
H -1.799368 3.304929 -0.777119
H 0.087991 -1.123123 2.114046
H 2.314741 -0.377862 1.483413
H 0.170561 -0.196625 -2.265571
H 1.674470 1.611752 -3.041120
H 3.483272 2.461191 -1.579719
H 5.515513 2.536879 1.507236
H 4.377455 3.425537 0.422172
H 5.484130 2.161396 -0.258642


%chk=000200896-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200896

0 1
O 0.386906 -1.700077 1.653531
O 4.131481 1.400531 0.931181
N -3.132237 0.597788 0.145075
C -1.342534 -1.157942 -0.054460
C 0.174314 -1.457966 0.201840
C -2.224964 -2.372047 0.322881
C -1.822327 0.123132 0.678359
C 0.600190 -2.788171 -0.480628
C -1.792106 -3.657004 -0.415296
C -0.311324 -3.977632 -0.110401
C 1.104706 -0.329123 -0.290857
C -3.886210 1.480007 1.081952
C -2.999001 1.445882 -1.078735
C -3.304540 2.920343 0.894284
C -2.820666 2.933335 -0.593165
C 2.195158 0.084467 0.503166
C 0.931950 0.262192 -1.574536
C 3.089761 1.082154 0.042742
C 1.825339 1.252424 -2.027134
C 2.911009 1.680698 -1.227402
C 5.106205 2.403091 0.497603
H -1.463417 -0.988335 -1.144641
H -3.276782 -2.112040 0.103147
H -2.143336 -2.543917 1.415384
H -1.033091 0.911438 0.620410
H -1.975510 -0.115495 1.750118
H 1.649021 -2.992260 -0.195497
H 0.585322 -2.628691 -1.577045
H -1.926327 -3.522031 -1.509777
H -2.438549 -4.504584 -0.115691
H -0.198261 -4.194402 0.968553
H 0.017221 -4.877967 -0.665676
H -4.954049 1.468211 0.786877
H -3.817721 1.103249 2.116557
H -2.157238 1.100238 -1.702241
H -3.925158 1.352144 -1.676737
H -2.453894 3.082254 1.581016
H -4.055817 3.702438 1.102285
H -3.420903 3.622829 -1.212963
H -1.766818 3.254443 -0.666453
H 0.152595 -0.870750 2.144457
H 2.379193 -0.380427 1.476084
H 0.109753 -0.054179 -2.225300
H 1.682361 1.700822 -3.017136
H 3.591982 2.451946 -1.599004
H 5.825020 2.481983 1.326442
H 4.625652 3.386343 0.326078
H 5.632143 2.082855 -0.423142


