%chk=000110465.chk %nprocshared=4 %mem=7GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000110465 0 1 N -2.034000 -0.9551000 -6.9999998E-04 N -0.1495000 -2.999500 1.9999999E-04 C 1.082800 1.007800 1.2000001E-03 C -0.2900000 0.7081000 5.0000002E-04 C 2.027000 -1.5000000E-02 1.3000000E-03 C -0.7264000 -0.6333000 -9.9999997E-05 C 0.2391000 -1.636100 9.9999997E-05 C 1.604200 -1.338500 6.9999998E-04 C 1.566800 2.427000 -1.9999999E-04 C -1.261700 1.718000 3.9999999E-04 C 3.491300 0.2775000 -2.4999999E-03 C -2.609700 1.389600 -1.9999999E-04 C -2.939900 4.9500000E-02 -7.9999998E-04 H 2.332600 -2.146600 1.9999999E-04 H 2.650800 2.554000 6.3000000E-03 H 1.206200 2.944100 -0.8966000 H 1.196600 2.949400 0.8893000 H -1.001100 2.772700 5.0000002E-04 H 3.781600 0.8331000 0.8954000 H 4.084100 -0.6446000 -4.6999999E-03 H 3.776800 0.8345000 -0.9010000 H -3.374500 2.157300 -3.9999999E-04 H -3.977600 -0.2674000 -1.3000000E-03 H 0.5522000 -3.727700 -5.0000002E-04 H -1.131900 -3.240100 -1.1000000E-03 %chk=000110465-Freq.chk %nprocshared=4 %mem=3GB #p freq=noraman PBEPBE/SDD 000110465 0 1 N -2.045880 -1.007220 0.000041 N -0.217069 -3.003897 -0.000218 C 1.140421 1.061491 -0.000435 C -0.263640 0.741158 -0.000200 C 2.069358 -0.005177 -0.000841 C -0.713125 -0.635775 -0.000139 C 0.261044 -1.707585 -0.000379 C 1.625915 -1.364164 -0.000827 C 1.574618 2.519400 -0.000657 C -1.301795 1.734424 -0.000227 C 3.571726 0.244693 -0.001328 C -2.647201 1.354467 -0.000054 C -2.979708 -0.035249 0.000100 H 2.378438 -2.162833 -0.001099 H 2.671135 2.617643 0.003330 H 1.199686 3.059480 -0.892618 H 1.193064 3.061647 0.887102 H -1.035265 2.796445 -0.000468 H 3.892747 0.818384 0.888815 H 4.129288 -0.707153 -0.002520 H 3.891917 0.820206 -0.890582 H -3.445774 2.103739 -0.000072 H -4.026857 -0.360225 0.000202 H 0.403851 -3.806317 -0.000836 H -1.231095 -3.118882 -0.000090