%chk=000271717.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271717

0 1
O 4.424552 1.844703 -0.502789
O -0.952033 -4.676008 1.042024
N -0.680895 -1.930820 0.840867
N 0.186427 -2.785688 0.202700
N 0.891280 -4.997836 -0.292307
C -1.458685 0.200654 1.605186
C -0.395792 -0.664767 0.964753
C -2.239635 0.955552 0.561671
C 0.854125 0.014214 0.542821
C 2.028271 -0.148363 1.303375
C 0.863835 0.824393 -0.598731
C -2.119873 2.348139 0.452692
C -3.098431 0.259946 -0.304456
C 3.204703 0.480662 0.920738
C 2.036984 1.467112 -1.004684
C 3.195745 1.287892 -0.238858
C -2.859625 3.039000 -0.512227
C -3.832981 0.955226 -1.266546
C -3.716032 2.345977 -1.372321
C 4.544411 2.713158 -1.656197
C -0.063490 -4.186341 0.382134
H -2.156970 -0.425944 2.210505
H -0.976874 0.888751 2.331561
H 2.009858 -0.768482 2.201465
H -0.055475 0.958965 -1.175270
H -1.453510 2.894253 1.117209
H -3.186100 -0.824972 -0.221516
H 4.125151 0.373550 1.490854
H 2.031269 2.091610 -1.891591
H -2.768104 4.120832 -0.591012
H -4.500471 0.413148 -1.934682
H -4.292369 2.885505 -2.120428
H 1.120549 -2.465165 -0.086538
H 4.333332 2.157473 -2.574078
H 5.602289 3.004290 -1.606752
H 3.893106 3.584824 -1.545294
H 0.657345 -5.984911 -0.336917
H 1.357111 -4.663332 -1.121261


%chk=000271717-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271717

0 1
O 4.621600 1.618695 -0.689812
O -1.123089 -4.678819 0.981569
N -0.690993 -1.889696 1.035031
N 0.205097 -2.782537 0.469346
N 0.875519 -4.918556 -0.198000
C -1.482089 0.308434 1.597770
C -0.396019 -0.599432 1.028611
C -2.322817 1.018084 0.531560
C 0.889477 -0.006507 0.534757
C 2.137595 -0.460032 1.061305
C 0.914205 1.035292 -0.428379
C -2.434549 2.430908 0.507999
C -3.025993 0.260679 -0.441694
C 3.354640 0.100816 0.638675
C 2.130645 1.603813 -0.867070
C 3.356820 1.133903 -0.333635
C -3.232750 3.077297 -0.464920
C -3.822773 0.903467 -1.414385
C -3.928934 2.315114 -1.430701
C 4.681211 2.703093 -1.674978
C -0.102053 -4.164363 0.459550
H -2.140638 -0.335809 2.209403
H -1.022872 1.059157 2.267108
H 2.146451 -1.231771 1.840121
H -0.026953 1.402920 -0.848727
H -1.898247 3.026554 1.257474
H -2.946768 -0.832883 -0.424951
H 4.311107 -0.231871 1.053302
H 2.108100 2.402183 -1.614835
H -3.312597 4.170559 -0.466778
H -4.364714 0.305326 -2.155945
H -4.549842 2.813225 -2.183914
H 1.057995 -2.436672 0.006920
H 4.255204 2.387090 -2.646884
H 5.751878 2.923852 -1.793222
H 4.151488 3.604798 -1.311718
H 0.723796 -5.922999 -0.234815
H 1.704859 -4.526112 -0.639038


