%chk=000207501.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207501

0 1
O 2.011210 -2.465620 -0.598077
N 3.078352 0.944216 0.751619
C 0.064650 -1.372624 0.370670
C 1.102478 -0.480638 1.090955
C -0.740180 -2.222267 1.417626
C 1.754264 0.559799 0.161281
C 3.563580 2.268743 0.238313
C 4.154066 -0.039134 0.385083
C -0.861190 -0.514806 -0.486841
C 4.540172 2.009238 -0.930414
C 4.942385 0.527519 -0.817261
C 0.806991 -2.406700 -0.502998
C 0.157712 -3.237632 2.133350
C -1.943144 -2.926986 0.784351
C -1.758604 0.457168 0.097345
C -0.829773 -0.645694 -1.860433
C -2.617291 1.204600 -0.755245
C -1.687028 0.112016 -2.706883
C -1.826164 0.730873 1.501425
C -2.570677 1.009774 -2.171821
C -3.523733 2.163809 -0.198373
C -2.695037 1.659498 2.015876
C -3.564324 2.386211 1.153968
H 1.889645 -1.131568 1.531187
H 0.639504 0.039628 1.952353
H -1.127680 -1.506634 2.192647
H 1.846526 0.158382 -0.871002
H 1.102966 1.457153 0.095445
H 4.089308 2.758608 1.085748
H 2.732058 2.934346 -0.051961
H 3.735370 -1.044112 0.165726
H 4.809144 -0.141920 1.274028
H 4.059204 2.213745 -1.900642
H 5.417388 2.671967 -0.869953
H 6.027314 0.413874 -0.667076
H 4.695856 -0.021114 -1.741253
H 0.154372 -3.126876 -1.025153
H 0.472816 -4.059508 1.481136
H 1.068426 -2.771015 2.530011
H -0.367798 -3.692186 2.981588
H -2.512482 -3.482044 1.539558
H -2.635809 -2.210286 0.323878
H -1.652485 -3.644599 0.010870
H -0.143101 -1.327361 -2.361498
H -1.622698 -0.041130 -3.783673
H -1.156791 0.182502 2.175663
H -3.239091 1.589949 -2.805345
H -4.176789 2.714300 -0.874310
H -2.730690 1.857008 3.086100
H -4.249100 3.114326 1.585409


%chk=000207501-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207501

0 1
O 1.910530 -2.759450 -0.675263
N 3.100931 0.957516 0.810137
C 0.058406 -1.429043 0.319210
C 1.205541 -0.641556 1.029966
C -0.781293 -2.300346 1.378119
C 1.858816 0.454626 0.160013
C 3.542283 2.294492 0.322910
C 4.291006 0.087670 0.553712
C -0.876274 -0.504975 -0.511608
C 4.353095 2.036448 -0.988806
C 4.978074 0.621335 -0.760599
C 0.686863 -2.491750 -0.603376
C 0.110896 -3.258929 2.205766
C -1.964033 -3.081393 0.749547
C -1.742869 0.501657 0.087010
C -0.879027 -0.619276 -1.913029
C -2.639070 1.264499 -0.771694
C -1.741256 0.147515 -2.752622
C -1.754049 0.834066 1.487695
C -2.628517 1.058740 -2.189353
C -3.519055 2.245033 -0.202758
C -2.610146 1.805082 2.011927
C -3.517830 2.511177 1.165458
H 1.990688 -1.365832 1.308847
H 0.856103 -0.179620 1.970201
H -1.220857 -1.571585 2.082024
H 2.044895 0.051273 -0.864607
H 1.162714 1.306161 0.049742
H 4.206387 2.742976 1.088211
H 2.678186 2.967339 0.188000
H 3.986643 -0.969014 0.468731
H 4.989254 0.177781 1.407193
H 3.673382 2.026379 -1.860227
H 5.116660 2.814025 -1.168306
H 6.073929 0.677169 -0.633293
H 4.779474 -0.047011 -1.616300
H -0.044233 -3.102573 -1.187144
H 0.592662 -4.025973 1.571258
H 0.906465 -2.724266 2.752223
H -0.510372 -3.788073 2.951884
H -2.624972 -3.455997 1.552558
H -2.572398 -2.445961 0.082904
H -1.623123 -3.961929 0.174766
H -0.195500 -1.317707 -2.407073
H -1.700098 0.005357 -3.837822
H -1.054427 0.346406 2.167073
H -3.312084 1.642558 -2.816861
H -4.189301 2.794273 -0.874972
H -2.577847 2.033244 3.083004
H -4.191155 3.264264 1.588620


