%chk=000179446.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179446

0 1
O 4.127995 0.495175 -0.355769
O 3.129065 2.344800 -1.127373
C 0.741309 -0.634205 0.308250
C -0.568947 -1.094311 0.027540
C -1.679208 -0.150340 -0.012138
C 0.951837 0.780397 0.579884
C -1.428825 1.220273 0.227397
C -0.086050 1.660193 0.526898
C 2.326847 1.277987 0.943494
C 1.814437 -1.565575 0.310731
C -0.773337 -2.479134 -0.219326
C -3.010756 -0.560707 -0.291402
C -2.499399 2.153697 0.178275
C 1.591201 -2.905610 0.064596
C 0.282081 -3.368616 -0.198602
C -4.040915 0.358067 -0.333006
C -3.783704 1.729054 -0.097560
C 3.166774 1.484121 -0.285154
H 0.065459 2.725645 0.706083
H 2.824842 0.568120 1.646145
H 2.267629 2.243137 1.498041
H 2.832622 -1.212397 0.495741
H -1.783351 -2.835255 -0.429718
H -3.212451 -1.617300 -0.475539
H -2.292115 3.207653 0.358858
H 2.418191 -3.613939 0.068140
H 0.117635 -4.428363 -0.387590
H -5.058986 0.037267 -0.548355
H -4.607037 2.440550 -0.137256
H 4.707754 0.575516 -1.159283


%chk=000179446-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179446

0 1
O 4.401487 0.625510 -0.200498
O 3.030952 2.118022 -1.335560
C 0.733366 -0.645274 0.306450
C -0.601379 -1.116245 0.010612
C -1.719725 -0.168454 -0.019361
C 0.954591 0.770693 0.581621
C -1.458059 1.221829 0.252279
C -0.112887 1.650175 0.550521
C 2.350970 1.294032 0.904968
C 1.814043 -1.584067 0.322006
C -0.786021 -2.509581 -0.246184
C -3.065308 -0.552612 -0.309063
C -2.529781 2.166952 0.227156
C 1.599055 -2.943848 0.066192
C 0.286396 -3.410385 -0.219339
C -4.104190 0.388657 -0.329709
C -3.838090 1.761755 -0.059956
C 3.243158 1.413810 -0.328233
H 0.054681 2.715924 0.749177
H 2.862319 0.667625 1.653711
H 2.260675 2.312800 1.322296
H 2.830488 -1.236906 0.530303
H -1.785554 -2.893250 -0.470617
H -3.303976 -1.598833 -0.522231
H -2.309165 3.220808 0.434458
H 2.439443 -3.646250 0.084631
H 0.113572 -4.473412 -0.419709
H -5.126632 0.066529 -0.555714
H -4.653872 2.492320 -0.079145
H 4.960038 0.727577 -1.019059


