%chk=000225955.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225955

0 1
O -0.878152 -1.002408 -0.097849
O 1.204022 -0.543852 0.824622
N -0.268816 -3.748360 -0.395735
C 0.257985 -1.570995 0.561737
C 0.750386 -2.654773 -0.435546
C -1.675766 -0.101907 0.720969
C 1.622849 0.275130 -0.301749
C -2.625217 0.555238 -0.278551
C 2.137611 1.557080 0.350930
C 2.106403 -3.202668 0.009659
C -3.578833 1.529358 0.422487
C 2.706925 2.521882 -0.695136
C -4.531081 2.192237 -0.569757
C 3.221310 3.806727 -0.050488
H 0.023934 -1.948978 1.577281
H 0.842464 -2.190156 -1.451308
H -2.201265 -0.708941 1.476952
H -1.002219 0.621091 1.213648
H 0.758890 0.450082 -0.966872
H 2.411602 -0.278035 -0.837131
H -3.193932 -0.227807 -0.818697
H -2.037897 1.076932 -1.059843
H 2.905923 1.302401 1.108521
H 1.319208 2.037484 0.922241
H 2.583742 -3.794582 -0.776493
H 2.002612 -3.850822 0.891948
H 2.788494 -2.387963 0.289057
H -2.998748 2.306347 0.958863
H -4.162024 0.994891 1.198567
H 1.929841 2.766615 -1.446126
H 3.527925 2.031481 -1.254779
H -1.176162 -3.391477 -0.692620
H -0.011397 -4.500414 -1.025866
H -3.988004 2.762579 -1.332176
H -5.148357 1.452746 -1.093100
H -5.210728 2.886588 -0.062760
H 2.424332 4.339212 0.481355
H 4.017870 3.603648 0.674879
H 3.628970 4.491790 -0.802336


%chk=000225955-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225955

0 1
O -0.905488 -0.920932 -0.254551
O 1.186164 -0.442924 0.857651
N -0.249142 -3.576450 -0.665892
C 0.235283 -1.481851 0.467464
C 0.819773 -2.581843 -0.443876
C -1.798900 -0.109734 0.599902
C 1.786519 0.325790 -0.257309
C -2.853324 0.538473 -0.300874
C 2.331567 1.631938 0.330007
C 2.033791 -3.256092 0.221200
C -3.869404 1.385102 0.501678
C 3.041144 2.505793 -0.730885
C -4.922079 2.060461 -0.403417
C 3.580595 3.827294 -0.142135
H -0.088150 -1.917005 1.434005
H 1.155064 -2.085587 -1.387541
H -2.274367 -0.770821 1.357151
H -1.200139 0.656762 1.132639
H 1.014318 0.523349 -1.027381
H 2.606245 -0.264201 -0.719874
H -3.386342 -0.254185 -0.861733
H -2.343806 1.173620 -1.051548
H 3.036120 1.390603 1.149810
H 1.495027 2.196623 0.786443
H 2.482148 -4.006749 -0.456532
H 1.717628 -3.771962 1.145426
H 2.807105 -2.513019 0.479892
H -3.327429 2.160814 1.080416
H -4.379550 0.740326 1.245880
H 2.336272 2.729150 -1.557732
H 3.877828 1.932972 -1.180774
H -1.098488 -3.157844 -1.058492
H 0.060053 -4.412758 -1.170448
H -4.439186 2.732153 -1.137928
H -5.500616 1.306175 -0.969291
H -5.636897 2.661976 0.187377
H 2.759825 4.435418 0.282450
H 4.305872 3.631057 0.669762
H 4.089665 4.435510 -0.912142


