%chk=000185426.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185426

1 1
O 3.507984 2.656977 -0.101591
O 1.477541 1.908491 -0.009777
O -4.379487 -2.059063 0.798881
N 2.363079 -0.742866 0.292343
N -1.162584 0.168082 -0.572494
N 4.517732 -1.441366 0.095642
N 2.710216 1.755714 -0.013588
N -5.909192 -0.647316 -0.132573
C 0.912893 -0.706213 0.518052
C 0.164852 -0.475049 -0.819587
C 3.225462 -1.850833 0.301425
C 3.182569 0.404678 0.071132
C -2.264819 -0.620143 -0.335168
C -1.271304 1.545334 -0.550044
C 4.510158 -0.073906 -0.038406
C 2.797634 -3.241352 0.515615
C -3.510674 -0.035851 -0.075592
C -2.502438 2.143117 -0.281872
C -3.635444 1.357790 -0.035176
C -4.633815 -1.008126 0.241416
H 0.681453 0.123875 1.241497
H 0.584372 -1.657870 1.000020
H 0.775843 0.190481 -1.489941
H 0.032367 -1.430991 -1.378949
H -2.155936 -1.724229 -0.334149
H -0.356073 2.157820 -0.736940
H 5.412941 0.508991 -0.207112
H 2.429391 -3.418489 1.541085
H 2.033015 -3.581371 -0.197288
H 3.662521 -3.933746 0.391339
H -2.568452 3.242701 -0.257633
H -4.596334 1.835544 0.199401
H -6.138059 0.169263 -0.671897
H -6.679109 -1.284077 0.063429


%chk=000185426-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185426

1 1
O 3.898809 2.619278 -0.365847
O 1.681557 2.077719 -0.161551
O -4.325663 -2.383294 0.015873
N 2.406866 -0.656370 0.286096
N -1.188234 0.188891 -0.542188
N 4.493465 -1.557359 0.112620
N 2.961724 1.761233 -0.184404
N -5.958675 -0.728935 -0.041329
C 0.961867 -0.557266 0.539095
C 0.170055 -0.400844 -0.794587
C 3.178760 -1.822921 0.355388
C 3.315326 0.393014 -0.010554
C -2.279250 -0.631852 -0.436981
C -1.306171 1.557833 -0.389222
C 4.587428 -0.196098 -0.108589
C 2.640294 -3.178988 0.680331
C -3.563119 -0.111325 -0.185674
C -2.563245 2.120165 -0.134768
C -3.704377 1.289471 -0.034299
C -4.657865 -1.163020 -0.062778
H 0.770801 0.316318 1.181391
H 0.646252 -1.467021 1.075731
H 0.710663 0.287471 -1.460314
H 0.035435 -1.368358 -1.304363
H -2.145288 -1.712671 -0.542364
H -0.383941 2.140097 -0.468927
H 5.530568 0.297029 -0.331037
H 2.245381 -3.235955 1.712142
H 1.840597 -3.499918 -0.012318
H 3.469845 -3.896861 0.599263
H -2.639447 3.203419 -0.016812
H -4.675595 1.747665 0.176959
H -6.244901 0.240221 -0.168430
H -6.691618 -1.434765 0.053949


