%chk=000220345.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220345

0 1
O 3.938512 -2.084016 1.414718
N -5.118731 1.911582 1.221808
C -1.281269 -0.741713 -0.399547
C -2.268804 0.392877 0.015341
C -3.771357 -0.020288 0.031367
C -1.540634 -1.961835 0.520895
C -1.999047 1.647467 -0.827695
C -3.954525 -1.293779 0.898753
C 0.147007 -0.218835 -0.213604
C -3.002226 -2.416895 0.483448
C -0.613231 2.209170 -0.490799
C -1.395930 -1.157441 -1.877013
C 0.444311 1.157259 -0.287778
C -4.399995 -0.199106 -1.356747
C 1.200790 -1.120968 -0.025090
C -4.525378 1.067831 0.703271
C 1.769891 1.592919 -0.144319
C 2.521190 -0.679811 0.112294
C 2.820638 0.690367 0.065261
C 4.242957 1.195115 0.236794
C 3.590771 -1.711336 0.318459
C 4.335558 2.122328 1.454548
C 4.717358 1.895455 -1.042771
C 4.191854 -2.257906 -0.946406
H -2.013548 0.642150 1.083308
H -1.252333 -1.705878 1.559796
H -0.885681 -2.805194 0.229155
H -2.767430 2.422658 -0.643484
H -2.062534 1.408768 -1.907304
H -5.002746 -1.643502 0.837541
H -3.785145 -1.043902 1.966078
H -3.138037 -3.284314 1.159573
H -3.261860 -2.782787 -0.529092
H -0.678389 2.824227 0.434505
H -0.296836 2.911856 -1.289644
H -2.401607 -1.531998 -2.115712
H -1.189319 -0.312760 -2.545043
H -0.681004 -1.949058 -2.123491
H -4.333242 0.714101 -1.958840
H -3.890345 -0.999398 -1.917134
H -5.460306 -0.469690 -1.289749
H 0.994481 -2.192407 0.020593
H 1.991350 2.658902 -0.191297
H 4.929964 0.329151 0.427505
H 3.739171 3.031991 1.329400
H 5.370693 2.430312 1.638291
H 3.976595 1.616668 2.360463
H 4.620534 1.241405 -1.915998
H 5.769141 2.191846 -0.961544
H 4.139701 2.803320 -1.249933
H 4.632550 -1.460140 -1.559243
H 3.435149 -2.753877 -1.568196
H 4.981222 -2.991992 -0.731688


%chk=000220345-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220345

0 1
O 4.917075 -1.292294 0.507166
N -5.082738 1.866222 1.266319
C -1.208767 -0.735918 -0.521990
C -2.236261 0.375791 -0.088880
C -3.753296 -0.067248 -0.032490
C -1.439228 -1.987337 0.385998
C -2.001986 1.685770 -0.871942
C -3.879456 -1.367007 0.836114
C 0.215907 -0.149953 -0.326678
C -2.906433 -2.472709 0.377645
C -0.640637 2.286210 -0.467623
C -1.294430 -1.170422 -2.020559
C 0.473922 1.251366 -0.360685
C -4.451097 -0.239705 -1.416593
C 1.327463 -1.009948 -0.193841
C -4.487653 1.010667 0.683456
C 1.810301 1.707942 -0.265762
C 2.669862 -0.556412 -0.069752
C 2.930514 0.859776 -0.117550
C 4.330597 1.476994 -0.005852
C 3.749175 -1.586726 0.104884
C 4.670634 1.747159 1.488454
C 4.510256 2.766555 -0.844909
C 3.432910 -3.055704 -0.202088
H -1.981398 0.593263 0.973306
H -1.144618 -1.735748 1.425247
H -0.787238 -2.819528 0.059149
H -2.803140 2.415788 -0.651733
H -2.027209 1.497842 -1.961075
H -4.925102 -1.727017 0.802978
H -3.659340 -1.110537 1.891119
H -3.007727 -3.340095 1.057662
H -3.185557 -2.839668 -0.628833
H -0.749771 2.780883 0.520345
H -0.340014 3.083880 -1.173768
H -2.213010 -1.734374 -2.249876
H -1.238917 -0.308104 -2.707253
H -0.436203 -1.826012 -2.255517
H -4.268425 0.630931 -2.068642
H -4.093564 -1.142149 -1.934653
H -5.542184 -0.337865 -1.278675
H 1.147592 -2.088358 -0.175690
H 1.978459 2.790016 -0.314129
H 5.061881 0.730609 -0.359594
H 3.950713 2.459234 1.934929
H 5.684429 2.180437 1.574265
H 4.650881 0.808531 2.066614
H 4.202117 2.617887 -1.896266
H 5.576178 3.059987 -0.839314
H 3.938829 3.620772 -0.435296
H 2.950279 -3.181553 -1.187572
H 2.757253 -3.483788 0.562929
H 4.378071 -3.619432 -0.179494


