%chk=000064157.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064157

0 1
 O    1.529700      -1.236400      2.2299999E-02
 N   0.5650000      0.8764000      8.7000001E-03
 C  -0.8171000      0.4456000      4.1000000E-03
 C   -2.580700     -0.8608000       1.258400    
 C   -3.224100       1.217500     -1.5900001E-02
 C   -2.563600     -0.8721000      -1.263200    
 C   -1.111900     -0.3991000       1.263000    
 C   -1.753500       1.673700     -7.7000000E-03
 C   -1.094900     -0.4106000      -1.252100    
 C   -3.499100      0.3729000       1.239900    
 C   -2.841900      -1.705400     -5.0000002E-04
 C   -3.481900      0.3620000      -1.268000    
 C    1.627900     -1.2500000E-02  1.7400000E-02
 C    2.960800      0.7153000      1.7899999E-02
 C    4.149200     -0.2433000      2.7600000E-02
 C    5.475600      0.5144000     -1.1300000E-02
 C    6.660500     -0.4378000     -4.0500000E-02
 H   -2.783400      -1.458600       2.154100    
 H   -3.882400       2.093400     -2.4300000E-02
 H   -2.754400      -1.477600      -2.156100    
 H  -0.9098000      0.1883000       2.168500    
 H  -0.4731000      -1.286300       1.326400    
 H   -1.552500       2.298400     -0.8879000    
 H   -1.564500       2.306100      0.8698000    
 H  -0.4558000      -1.298600      -1.299300    
 H  -0.8805000      0.1690000      -2.159900    
 H   -3.333800      0.9765000       2.140800    
 H   -4.549700      5.7700001E-02   1.256100    
 H   -2.203500      -2.597400      7.7999998E-03
 H   -3.880800      -2.057300     -6.0000001E-03
 H   -3.304000      0.9577000      -2.171700    
 H   -4.532200      4.6799999E-02  -1.296000    
 H   0.7593000       1.873900      5.2000000E-03
 H    2.997400       1.365600      0.9002000    
 H    3.001000       1.352700     -0.8736000    
 H    4.108400     -0.8745000      0.9240000    
 H    4.085100     -0.9174000     -0.8359000    
 H    5.557600       1.166300      0.8663000    
 H    5.511600       1.157800     -0.8981000    
 H    6.625600      -1.080700     -0.9258000    
 H    6.672200      -1.076700      0.8483000    
 H    7.598700      0.1254000     -6.6500001E-02


%chk=000064157-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000064157

0 1
O 1.580140 -1.295623 0.546131
N 0.593574 0.785698 0.149801
C -0.829003 0.351608 0.071100
C -2.774666 -0.729086 1.302229
C -3.195769 1.233213 -0.246410
C -2.547511 -1.021464 -1.207928
C -1.276326 -0.333889 1.396268
C -1.695042 1.622163 -0.156236
C -1.047626 -0.628637 -1.119701
C -3.632788 0.544863 1.076020
C -2.978934 -1.710271 0.115714
C -3.405638 0.253066 -1.432780
C 1.679829 -0.036495 0.392814
C 3.032455 0.687085 0.494822
C 4.179335 -0.118452 -0.156233
C 5.570161 0.494204 0.119596
C 6.714264 -0.316147 -0.527368
H -3.078559 -1.220085 2.247561
H -3.796823 2.149705 -0.408076
H -2.688819 -1.721313 -2.054916
H -1.115168 0.367648 2.239548
H -0.645140 -1.222230 1.573503
H -1.379894 2.126029 -1.094017
H -1.540085 2.335388 0.680036
H -0.414618 -1.521300 -0.970421
H -0.722104 -0.137149 -2.058613
H -3.509130 1.243165 1.928403
H -4.707365 0.278486 1.023119
H -2.379937 -2.628028 0.277148
H -4.042803 -2.016369 0.055475
H -3.119180 0.740480 -2.386658
H -4.477732 -0.016954 -1.511729
H 0.777789 1.783783 0.023564
H 3.257375 0.817227 1.573742
H 2.975881 1.703958 0.056428
H 4.133783 -1.154187 0.229283
H 4.011596 -0.184254 -1.250208
H 5.731202 0.550890 1.215999
H 5.598736 1.538818 -0.253897
H 6.593437 -0.365896 -1.625992
H 6.726409 -1.354161 -0.145342
H 7.701195 0.134813 -0.315276


