%chk=000118194.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000118194

0 1
O -2.413704 2.874364 -0.708343
C -2.839933 -1.269040 0.295041
C -1.627199 -2.048106 0.846959
C -0.513526 -2.293044 -0.178064
C -2.462065 0.085163 -0.337257
C 0.695721 -2.985417 0.465482
C 1.919278 -3.021844 -0.461113
C 2.504664 -1.636289 -0.770450
C 3.035176 -0.924489 0.480472
C 3.691296 0.427220 0.169293
C -1.707111 1.008398 0.622901
C 2.746605 1.468734 -0.446202
C 1.583720 1.848178 0.479146
C -3.622937 -2.109986 -0.722083
C 0.799570 3.046314 -0.072385
C -0.519754 3.290046 0.672899
C -1.633728 2.427277 0.102569
H -3.518023 -1.064566 1.163652
H -1.978529 -3.019340 1.247565
H -1.215527 -1.501949 1.717538
H -0.195981 -1.331162 -0.629032
H -0.896830 -2.903240 -1.017322
H -3.383769 0.598767 -0.687695
H -1.857086 -0.074340 -1.250909
H 0.423743 -4.019499 0.752480
H 0.964460 -2.473895 1.410703
H 1.647995 -3.518844 -1.413269
H 2.699862 -3.660125 -0.002685
H 1.731170 -1.006934 -1.255476
H 3.317441 -1.741851 -1.514467
H 3.772209 -1.573757 0.992650
H 2.208456 -0.782846 1.204318
H 4.545720 0.271243 -0.519436
H 4.131162 0.834322 1.101392
H -0.676383 0.615705 0.799377
H -2.197798 1.020078 1.617142
H 2.348139 1.089513 -1.407941
H 3.332985 2.373978 -0.701150
H 1.962848 2.078877 1.492465
H 0.904032 0.973770 0.602807
H -3.024303 -2.330590 -1.612793
H -3.932352 -3.068545 -0.292506
H -4.528571 -1.592364 -1.056877
H 0.596508 2.908885 -1.154310
H 1.424005 3.959770 -0.006466
H -0.809379 4.357382 0.567269
H -0.397174 3.120177 1.757911


%chk=000118194-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000118194

0 1
O -1.732640 2.450817 -1.386298
C -2.980583 -1.348642 0.411144
C -1.674475 -2.053794 0.892495
C -0.553920 -2.186186 -0.166768
C -2.725976 0.022882 -0.272572
C 0.682884 -2.946937 0.368148
C 1.900888 -2.937652 -0.593192
C 2.550173 -1.546686 -0.825314
C 3.152833 -0.918981 0.453680
C 3.870507 0.437183 0.229349
C -1.984294 1.051059 0.602542
C 2.983096 1.571744 -0.348049
C 1.682830 1.825830 0.449086
C -3.798194 -2.261035 -0.536647
C 0.942159 3.107725 -0.000793
C -0.508395 3.221672 0.561362
C -1.451578 2.258853 -0.171081
H -3.600808 -1.170549 1.317411
H -1.943119 -3.064805 1.263763
H -1.261782 -1.513478 1.770228
H -0.247147 -1.176075 -0.501308
H -0.937839 -2.705794 -1.067721
H -3.693841 0.453923 -0.593328
H -2.152710 -0.128496 -1.206668
H 0.394677 -3.998760 0.572141
H 0.978024 -2.519151 1.348447
H 1.585939 -3.355905 -1.571705
H 2.675494 -3.625475 -0.194711
H 1.804455 -0.856842 -1.267499
H 3.353585 -1.651866 -1.583543
H 3.878037 -1.635372 0.893042
H 2.358623 -0.787237 1.214394
H 4.734521 0.281914 -0.449350
H 4.291665 0.775466 1.198958
H -1.119336 0.592413 1.124083
H -2.635681 1.428701 1.420698
H 2.715791 1.346684 -1.400124
H 3.581214 2.506068 -0.377677
H 1.915059 1.896106 1.532677
H 1.015327 0.949333 0.331324
H -3.242287 -2.471364 -1.469630
H -4.032461 -3.229351 -0.056149
H -4.753896 -1.782590 -0.821523
H 0.882935 3.145780 -1.106228
H 1.523587 3.995220 0.317393
H -0.877383 4.250533 0.388087
H -0.510854 3.029211 1.651222


