%chk=000277055.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277055

0 1
O -4.374244 -1.749805 -0.339878
O 1.053978 -2.896342 -0.418773
O -3.662943 3.046515 0.170875
O 5.634910 -1.064252 -0.189175
N -4.369231 0.862965 -0.065173
N 4.891439 1.108746 0.031882
C -0.701505 0.176374 -0.109137
C 0.702469 0.626704 -0.050981
C -0.718350 -1.236885 -0.257866
C 1.553406 -0.517632 -0.164752
C 0.693363 -1.755607 -0.301557
C -1.880618 0.904177 -0.041673
C -1.907894 -1.942510 -0.341202
C 1.248595 1.889038 0.085959
C 2.922977 -0.411296 -0.143017
C -3.104501 0.212074 -0.123852
C -3.098596 -1.208829 -0.273231
C 3.478943 0.892037 -0.001693
C 2.650077 2.019769 0.110510
C -4.578384 2.253495 0.080038
C 5.895653 0.112853 -0.064222
C -4.481913 -3.185265 -0.492223
C -6.030238 2.640711 0.109622
C 7.292632 0.663424 0.004224
H -1.868209 1.994731 0.073112
H -1.898016 -3.025175 -0.454912
H 0.616649 2.772227 0.173953
H 3.566358 -1.297651 -0.231223
H 3.077287 3.014988 0.218474
H -5.182933 0.239669 -0.137136
H 5.183158 2.082743 0.135968
H -4.024543 -3.502710 -1.434372
H -5.570225 -3.325669 -0.515213
H -4.038061 -3.693174 0.369526
H -6.557322 2.373104 -0.816169
H -6.120976 3.734761 0.223989
H -6.570835 2.187219 0.951411
H 7.513724 1.360558 -0.814792
H 8.020476 -0.163216 -0.077776
H 7.500544 1.173433 0.954157


%chk=000277055-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277055

0 1
O -4.435513 -1.697785 -0.333341
O 1.030847 -2.928754 -0.430887
O -3.800160 3.161613 0.174930
O 5.783625 -1.154302 -0.201090
N -4.382753 0.898827 -0.060049
N 4.967655 1.036505 0.027631
C -0.691126 0.222547 -0.108994
C 0.730770 0.648478 -0.053105
C -0.727763 -1.192873 -0.259176
C 1.558988 -0.507753 -0.169339
C 0.672443 -1.724270 -0.304937
C -1.877691 0.970712 -0.037881
C -1.942102 -1.896134 -0.341103
C 1.327241 1.912372 0.086251
C 2.956758 -0.446977 -0.150988
C -3.116152 0.276469 -0.118620
C -3.136203 -1.153036 -0.269548
C 3.558854 0.840202 -0.007626
C 2.739434 1.998131 0.108271
C -4.681131 2.258220 0.078391
C 5.991475 0.084699 -0.065086
C -4.554511 -3.150940 -0.482899
C -6.179210 2.556439 0.101290
C 7.395215 0.687096 0.013296
H -1.892876 2.055864 0.076013
H -1.932537 -2.983720 -0.455631
H 0.724849 2.822104 0.177412
H 3.573313 -1.343254 -0.241748
H 3.213680 2.982308 0.217838
H -5.166593 0.240964 -0.131946
H 5.269740 2.008130 0.135010
H -4.086454 -3.490002 -1.425954
H -5.634845 -3.354604 -0.506861
H -4.091432 -3.674533 0.374347
H -6.667676 2.225107 -0.833667
H -6.319747 3.641056 0.210461
H -6.676302 2.045109 0.946296
H 7.570477 1.408916 -0.806030
H 8.128483 -0.127272 -0.071305
H 7.556026 1.210635 0.974074


