%chk=000019751.chk %nprocshared=8 %mem=31GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000019751 0 1 C -5.9300002E-02 1.0400000E-02 0.2654000 C 0.7729000 -1.188500 -0.1789000 C 0.7829000 1.187300 -0.2164000 C -1.466500 7.4000000E-03 -0.3059000 C 2.211800 -0.7660000 0.1014000 C 2.215800 0.7636000 8.9199997E-02 C -2.217200 -1.262200 0.1006000 C -2.240500 1.248000 0.1446000 H -9.9399999E-02 2.6400000E-02 1.363900 H 0.6476000 -1.378900 -1.252000 H 0.5189000 -2.106400 0.3600000 H 0.5314000 2.125400 0.2877000 H 0.6654000 1.340300 -1.296200 H -1.419800 2.6100000E-02 -1.402700 H 2.899700 -1.180700 -0.6423000 H 2.533100 -1.129700 1.084300 H 2.523900 1.140700 1.071300 H 2.916700 1.163800 -0.6504000 H -2.244900 -1.376900 1.189700 H -3.251600 -1.231200 -0.2592000 H -1.756700 -2.158000 -0.3273000 H -2.284300 1.315000 1.237000 H -3.269200 1.219100 -0.2310000 H -1.784500 2.166800 -0.2369000 %chk=000019751-Freq.chk %nprocshared=8 %mem=31GB #p freq=noraman PBEPBE/SDD 000019751 0 1 C -0.058971 -0.000872 0.257091 C 0.810265 -1.208870 -0.192097 C 0.808172 1.207886 -0.193535 C -1.507072 -0.003146 -0.302485 C 2.281117 -0.782400 0.086709 C 2.277132 0.785912 0.097583 C -2.282649 -1.273447 0.124047 C -2.286762 1.264797 0.123671 H -0.117336 0.000207 1.368866 H 0.655860 -1.373601 -1.278468 H 0.543421 -2.148947 0.322928 H 0.535967 2.149989 0.314917 H 0.660433 1.366008 -1.281870 H -1.428267 -0.003195 -1.412465 H 2.972398 -1.190132 -0.672930 H 2.616658 -1.172138 1.065733 H 2.595704 1.162989 1.087275 H 2.977157 1.208677 -0.645632 H -2.353177 -1.334438 1.227827 H -3.313068 -1.261130 -0.278290 H -1.789493 -2.194082 -0.235497 H -2.359535 1.324566 1.227368 H -3.316375 1.250143 -0.280656 H -1.795379 2.187025 -0.234190