%chk=000184762.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184762

0 1
O -0.021115 -1.343037 0.093037
O 0.553574 0.349335 1.482006
C 2.770840 0.880378 -0.745417
C 3.403500 0.031237 0.357915
C 2.076488 -0.419624 -0.268365
C 2.169695 2.210603 -0.365310
C 3.353946 0.861081 -2.137909
C 4.622749 -0.774432 0.131511
C 0.846243 -0.362496 0.547810
C 5.867966 -0.274340 0.192169
C 7.069610 -1.143636 -0.016513
C 6.156530 1.165021 0.482833
C -1.334230 -1.426655 0.717148
C -2.347351 -0.682512 -0.109417
C -3.540309 -0.259836 0.489756
C -2.117366 -0.436077 -1.469842
C -4.507945 0.412509 -0.271799
C -3.080511 0.236998 -2.224237
C -4.273773 0.660966 -1.632288
C -5.795223 0.852081 0.373566
C -5.565603 1.790077 1.524551
C -6.381810 1.875839 2.572782
H 3.347129 0.429092 1.386806
H 2.089248 -1.278920 -0.957072
H 1.676920 2.184644 0.621517
H 2.934665 2.994460 -0.323436
H 1.406270 2.527585 -1.087148
H 2.572230 0.991915 -2.896507
H 3.875974 -0.079443 -2.358984
H 4.085410 1.668417 -2.270058
H 4.444886 -1.830169 -0.070010
H 6.816492 -2.207685 -0.107341
H 7.776731 -1.051011 0.819451
H 7.607168 -0.859388 -0.931708
H 5.393662 1.830346 0.053477
H 7.128004 1.488415 0.090801
H 6.165187 1.345145 1.567792
H -1.523051 -2.518153 0.713829
H -1.271793 -1.048199 1.757230
H -3.720458 -0.440699 1.548211
H -1.184101 -0.768452 -1.925086
H -2.901444 0.432432 -3.280546
H -5.016242 1.185610 -2.229021
H -6.459226 1.355641 -0.364086
H -6.363863 -0.046880 0.699922
H -4.675174 2.416738 1.434117
H -7.267851 1.272902 2.701346
H -6.221078 2.564176 3.389718


%chk=000184762-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000184762

0 1
O 0.041663 -1.590846 -0.597925
O 0.308488 -0.290871 1.332635
C 2.146689 1.493099 -0.578407
C 3.034911 0.542589 0.241288
C 1.826406 -0.036269 -0.576829
C 1.240785 2.456603 0.186200
C 2.658430 2.057214 -1.903737
C 4.427001 0.181044 -0.129141
C 0.682168 -0.604160 0.170723
C 5.428871 -0.194404 0.722115
C 6.814136 -0.522509 0.189220
C 5.283944 -0.322158 2.227914
C -1.159995 -2.250798 0.027814
C -2.443240 -1.621888 -0.469553
C -2.900531 -0.398802 0.080917
C -3.198442 -2.248682 -1.492093
C -4.093301 0.210746 -0.379148
C -4.391786 -1.654143 -1.956209
C -4.834613 -0.430825 -1.403847
C -4.581006 1.525702 0.234209
C -3.521860 2.614694 0.246184
C -3.093382 3.270262 1.353718
H 2.815123 0.570501 1.314778
H 2.061788 -0.568731 -1.502311
H 0.856369 2.008651 1.117111
H 1.804545 3.373861 0.441783
H 0.371564 2.752429 -0.432320
H 1.808958 2.390018 -2.528569
H 3.234252 1.320047 -2.489554
H 3.312059 2.931586 -1.722642
H 4.667730 0.223226 -1.201828
H 6.869878 -0.417594 -0.908297
H 7.105599 -1.559671 0.450860
H 7.580746 0.141789 0.636648
H 4.267397 -0.102933 2.590941
H 5.986518 0.360240 2.746760
H 5.543332 -1.348802 2.554970
H -1.069985 -3.301742 -0.289692
H -1.057212 -2.162697 1.123561
H -2.311531 0.085492 0.869507
H -2.849251 -3.193978 -1.925115
H -4.975097 -2.139867 -2.746474
H -5.761341 0.029473 -1.768919
H -5.463036 1.877831 -0.337758
H -4.925271 1.352204 1.273078
H -3.085817 2.863787 -0.733324
H -3.494530 3.040147 2.348965
H -2.326523 4.051138 1.298994


