%chk=000141876.chk %nprocshared=4 %mem=7GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000141876 0 1 N -0.1505000 0.2422000 -3.9999999E-04 N 1.200000 -1.549300 -9.9999997E-05 C 1.141000 0.7150000 -3.0000001E-04 C -5.5500001E-02 -1.150200 -6.0000003E-04 C -1.371200 0.9398000 0.000000 C 1.944200 -0.4000000 9.9999997E-05 C -1.273000 -1.888400 -3.0000001E-04 C 1.532200 2.138300 -1.9999999E-04 C -2.509900 0.2172000 5.0000002E-04 C -1.423700 2.438500 9.9999997E-05 C -2.448000 -1.234000 5.0000002E-04 C 3.414500 -0.4692000 7.9999998E-04 H -1.239400 -2.972100 -3.9999999E-04 H 1.183300 2.654300 0.8975000 H 2.623800 2.239000 -5.0000002E-04 H 1.182900 2.654400 -0.8978000 H -3.491200 0.6785000 8.9999998E-04 H -0.9626000 2.854900 0.8992000 H -2.460400 2.797300 3.0000001E-04 H -0.9629000 2.855000 -0.8991000 H -3.385900 -1.778800 8.9999998E-04 H 3.760500 -1.507800 1.1000000E-03 H 3.825300 2.1100000E-02 -0.8874000 H 3.824600 2.1400001E-02 0.8891000 %chk=000141876-Freq.chk %nprocshared=4 %mem=7GB #p freq=noraman PBEPBE/SDD 000141876 0 1 N -0.181074 0.291998 0.000154 N 1.189570 -1.571730 0.000276 C 1.157458 0.755572 0.000181 C -0.101755 -1.153779 0.000229 C -1.425927 0.948021 0.000141 C 1.957873 -0.408030 0.000250 C -1.295118 -1.923326 0.000248 C 1.628397 2.183845 0.000120 C -2.575415 0.160032 0.000164 C -1.499759 2.458513 -0.000001 C -2.527222 -1.273048 0.000202 C 3.461198 -0.480106 0.000271 H -1.195113 -3.011506 0.000285 H 1.306136 2.750149 0.893447 H 2.731662 2.178974 -0.000169 H 1.305677 2.750247 -0.892966 H -3.543306 0.669886 0.000126 H -1.020989 2.900831 0.891823 H -2.558762 2.764213 -0.000039 H -1.020984 2.900652 -0.891907 H -3.461359 -1.843081 0.000231 H 3.763331 -1.539733 0.000428 H 3.901801 0.004117 -0.892045 H 3.901781 0.004387 0.892449