%chk=000179391.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179391

0 1
O -4.430734 0.402928 -0.412653
O -3.915844 -1.611027 -1.245395
C 0.493590 0.729636 0.112816
C 1.328423 -0.449013 0.071016
C -0.906523 0.614990 0.348288
C 0.751304 -1.733718 0.262735
C -1.461841 -0.718921 0.570004
C 1.079182 2.010862 -0.091190
C 2.725782 -0.330416 -0.167973
C -0.673728 -1.825435 0.516000
C -1.690489 1.779981 0.352116
C 2.511000 2.100954 -0.325188
C 3.290806 0.994327 -0.361532
C -2.928223 -0.864440 0.884351
C 1.569029 -2.874400 0.208887
C 0.265599 3.154686 -0.066512
C 3.518125 -1.488770 -0.213218
C -1.107751 3.032682 0.149230
C 2.939384 -2.746282 -0.027241
C -3.756801 -0.801475 -0.367470
H -1.088851 -2.824268 0.659479
H -2.771615 1.714593 0.500696
H 2.933116 3.095220 -0.471911
H 4.364036 1.062550 -0.538293
H -3.249670 -0.078689 1.608974
H -3.133085 -1.833544 1.395756
H 1.132757 -3.862032 0.349599
H 0.706459 4.138516 -0.220096
H 4.588317 -1.406650 -0.395935
H -1.734486 3.924358 0.157847
H 3.564542 -3.638220 -0.067547
H -4.988813 0.503618 -1.229342


%chk=000179391-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179391

0 1
O -4.716501 0.341289 -0.298348
O -3.799418 -1.487830 -1.397497
C 0.520123 0.729632 0.106266
C 1.350155 -0.443052 0.072140
C -0.901082 0.618177 0.349247
C 0.762532 -1.742076 0.279562
C -1.472540 -0.707516 0.571079
C 1.115602 2.028170 -0.105323
C 2.767818 -0.329803 -0.171448
C -0.657401 -1.827248 0.530822
C -1.686418 1.804900 0.362813
C 2.541114 2.116223 -0.344811
C 3.335823 0.985311 -0.376779
C -2.962907 -0.869744 0.856061
C 1.590923 -2.895796 0.239204
C 0.292035 3.185259 -0.075223
C 3.561626 -1.508521 -0.203142
C -1.093120 3.068989 0.154888
C 2.976486 -2.776550 -0.000724
C -3.826107 -0.743807 -0.396829
H -1.094046 -2.820976 0.688916
H -2.766633 1.745783 0.526137
H 2.979744 3.108532 -0.503065
H 4.413636 1.066492 -0.560395
H -3.315251 -0.141781 1.604755
H -3.141404 -1.883237 1.256809
H 1.142382 -3.883786 0.395050
H 0.745374 4.170438 -0.235650
H 4.638717 -1.423302 -0.388824
H -1.719374 3.967665 0.171571
H 3.602218 -3.675073 -0.030162
H -5.261106 0.395838 -1.130799


