%chk=000105721.chk %nprocshared=4 %mem=7GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000105721 0 1 O 0.9329000 2.369000 -0.7302000 O 4.057500 -1.167500 -7.4900001E-02 O -2.341500 -0.7288000 -0.9674000 O -1.474700 1.975500 0.5216000 O -3.139800 -0.2726000 1.168600 C 0.1843000 0.2960000 0.2170000 C 1.195700 1.099800 -0.3090000 C 0.4744000 -0.9993000 0.6456000 C 2.497500 0.6081000 -0.4065000 C 2.787700 -0.6873000 2.2000000E-02 C 1.776100 -1.490900 0.5480000 C -1.180600 0.7909000 0.3321000 C -2.360200 -0.1447000 0.2455000 C -3.409300 -1.648200 -1.212500 H -0.2919000 -1.642800 1.069300 H 3.281700 1.239500 -0.8173000 H 1.996700 -2.500000 0.8853000 H -1.5000000E-02 2.563800 -0.6596000 H 4.626400 -0.4793000 -0.4607000 H -3.368900 -2.475100 -0.4968000 H -3.286700 -2.051200 -2.221300 H -4.373500 -1.134200 -1.154200 %chk=000105721-Freq.chk %nprocshared=4 %mem=3GB #p freq=noraman PBEPBE/SDD 000105721 0 1 O 1.106506 2.572757 -0.292728 O 4.158428 -1.171661 0.071393 O -2.433440 -1.047058 -0.856864 O -1.382222 2.106376 -0.194614 O -3.262451 0.133769 0.978850 C 0.197435 0.297787 -0.053497 C 1.309418 1.224256 -0.157120 C 0.490055 -1.096479 0.089990 C 2.639480 0.750352 -0.119215 C 2.875090 -0.630799 0.024979 C 1.801885 -1.564995 0.131949 C -1.148505 0.840736 -0.072439 C -2.384009 -0.048860 0.113060 C -3.661582 -1.889616 -0.847218 H -0.338753 -1.807020 0.152780 H 3.454182 1.478001 -0.201644 H 2.036116 -2.626602 0.239789 H 0.083356 2.735515 -0.292989 H 4.853001 -0.470090 -0.005308 H -3.747203 -2.425296 0.112803 H -3.526941 -2.585815 -1.685716 H -4.551045 -1.254557 -0.991640