%chk=000232649.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232649

0 1
O -0.849200 -0.213823 1.066566
O 5.257604 0.574690 -0.279805
O -0.660837 -1.871039 -0.456755
N -4.515038 -0.211353 0.436521
N 4.289515 -1.267093 -1.984399
C -6.892080 0.195998 -0.209858
C -5.416288 0.612976 -0.428119
C -7.375677 0.597415 1.186717
C -7.770116 0.831615 -1.295310
C -3.076396 0.022356 0.112466
C -2.252863 -0.550911 1.272972
C 1.266406 -0.498748 0.080205
C -0.134200 -0.966641 0.154083
C 2.114985 -1.131208 -0.853255
C 3.447567 -0.737980 -0.967106
C 3.922852 0.308601 -0.105879
C 1.740986 0.527973 0.896681
C 3.079574 0.936112 0.807573
C 5.861104 1.645539 0.521085
C 7.298220 1.657876 0.041909
H -6.968658 -0.916459 -0.303800
H -5.279766 1.678392 -0.139864
H -5.161466 0.540390 -1.507325
H -4.732473 -1.207203 0.307993
H -7.410151 1.685022 1.308687
H -8.376359 0.207155 1.393392
H -6.695909 0.211596 1.958986
H -8.823527 0.564648 -1.153368
H -7.710414 1.925322 -1.277205
H -7.481389 0.499695 -2.297769
H -2.879824 1.113448 0.023936
H -2.748514 -0.437912 -0.846458
H -2.463470 -0.049832 2.235470
H -2.352553 -1.645151 1.369534
H 1.710030 -1.923588 -1.488887
H 1.069071 1.013126 1.609625
H 3.435364 1.733135 1.453228
H 5.763181 1.377483 1.586823
H 5.326299 2.585324 0.299836
H 4.124686 -2.243809 -2.194151
H 5.278407 -1.091163 -1.831207
H 7.872934 2.456346 0.526065
H 7.801378 0.703622 0.249418
H 7.353803 1.813257 -1.045651


%chk=000232649-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000232649

0 1
O -0.878074 -0.177579 1.034123
O 5.377633 0.518384 -0.283988
O -0.597160 -1.941327 -0.472178
N -4.564723 -0.209360 0.242381
N 4.451626 -1.564821 -1.666870
C -6.995817 0.195915 -0.215708
C -5.534128 0.606299 -0.523698
C -7.359989 0.481999 1.258694
C -7.968308 0.905948 -1.185642
C -3.148508 0.181765 0.088953
C -2.312924 -0.543764 1.157511
C 1.304715 -0.520196 0.096734
C -0.109844 -0.967243 0.160256
C 2.186148 -1.249461 -0.744819
C 3.545932 -0.886363 -0.858687
C 4.010853 0.240636 -0.099871
C 1.779388 0.589467 0.837670
C 3.136765 0.965590 0.735241
C 5.957261 1.659354 0.451249
C 7.432981 1.735445 0.069913
H -7.079195 -0.900243 -0.388161
H -5.389473 1.667628 -0.235838
H -5.365848 0.546774 -1.629073
H -4.697752 -1.213228 0.050730
H -7.383136 1.573655 1.445081
H -8.356336 0.073992 1.511573
H -6.609077 0.036998 1.934250
H -9.015099 0.619442 -0.975164
H -7.893708 2.005533 -1.077814
H -7.749790 0.652216 -2.240166
H -3.071011 1.273693 0.246746
H -2.725209 -0.039739 -0.919061
H -2.605935 -0.223846 2.168881
H -2.412927 -1.640212 1.055178
H 1.787199 -2.102434 -1.305028
H 1.092983 1.142516 1.482397
H 3.501275 1.822590 1.309148
H 5.828696 1.492798 1.540106
H 5.417637 2.585788 0.167756
H 4.161096 -2.366050 -2.217373
H 5.416495 -1.248213 -1.699953
H 7.916422 2.577474 0.597600
H 7.956892 0.804539 0.346643
H 7.548771 1.892839 -1.016120


