%chk=000261817.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261817

0 1
O 1.673791 -1.493469 -0.269915
O -1.676193 -2.731789 -0.883962
O -0.549268 -2.962039 0.948066
O 2.765677 2.327393 -0.606878
O 3.331011 0.634323 0.614826
O -3.283377 2.525420 0.013340
N -0.971534 -2.312588 0.010701
N 2.524604 1.296205 -0.008978
N -2.106519 2.641911 -0.012770
C -1.634486 0.108927 -0.020128
C -0.615222 -0.871658 -0.015578
C 0.750327 -0.515506 -0.038552
C 1.115501 0.849230 -0.013822
C -1.242196 1.472272 -0.015820
C 0.115752 1.831241 -0.025931
C -3.055084 -0.298681 -0.009251
C 2.343427 -2.069861 0.897680
H 0.403421 2.896987 -0.044945
H -3.369361 -0.671208 0.981940
H -3.759534 0.517218 -0.260174
H -3.269401 -1.112087 -0.732147
H 1.598775 -2.585794 1.516334
H 2.890900 -1.288007 1.438067
H 3.030690 -2.776739 0.412697


%chk=000261817-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000261817

0 1
O 1.643505 -1.563852 -0.214831
O -1.558904 -2.731185 -1.135911
O -0.637032 -2.989551 0.939306
O 2.708188 2.554907 -0.442973
O 3.458368 0.536439 0.300926
O -3.371681 2.491455 0.102921
N -0.954878 -2.286011 -0.092878
N 2.515528 1.342295 -0.048454
N -2.105584 2.680886 0.082053
C -1.679240 0.110115 -0.011634
C -0.629029 -0.833044 -0.048066
C 0.766424 -0.524160 -0.021491
C 1.113229 0.863077 0.007887
C -1.259079 1.487012 0.041271
C 0.107862 1.840943 0.032766
C -3.134087 -0.295023 -0.005424
C 2.420926 -2.151128 0.920517
H 0.375242 2.902471 0.032745
H -3.641732 0.105020 0.889445
H -3.662626 0.157011 -0.863533
H -3.266959 -1.385221 -0.049303
H 1.712088 -2.668641 1.588149
H 2.992356 -1.365045 1.434753
H 3.098814 -2.867069 0.436558


