%chk=000152533.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152533

0 1
 O    5.170100     -0.8460000      1.7800000E-02
 N    4.298300      0.2138000     -6.2000002E-03
 C   7.3399998E-02 -0.2875000     -2.4000001E-03
 C   -1.361600     -0.4058000     -7.9999998E-04
 C   0.6619000       1.004200     -1.7000000E-03
 C   -2.153200      0.7725000      1.5000000E-03
 C  -0.1509000       2.140600      5.0000002E-04
 C   -1.537200       2.026400      2.3000001E-03
 C   0.9624000      -1.391300     -4.1000000E-03
 C    2.059500       1.153500     -2.9000000E-03
 C   -2.058400      -1.640300     -1.2000001E-03
 C    2.899200      4.4100001E-02 -4.6999999E-03
 C   -3.556200      0.6914000      3.4000000E-03
 C    2.350500      -1.228900     -4.9999999E-03
 C   -3.454400      -1.706700      5.0000002E-04
 C   -4.203400     -0.5402000      2.7999999E-03
 H   0.2869000       3.137100      1.1000000E-03
 H   -2.132400       2.937800      4.1999999E-03
 H   0.5896000      -2.412400     -4.6000001E-03
 H    2.497900       2.151000     -2.4000001E-03
 H   -1.524100      -2.586900     -2.9000000E-03
 H   -4.162500       1.595600      5.4000001E-03
 H    2.976000      -2.117500     -6.8000001E-03
 H   -3.950800      -2.672800       0.000000    
 H   -5.288100     -0.5866000      4.3000001E-03
 H    4.700800       1.142500      3.7000000E-03
 H    5.641800     -0.7354000     -0.8251000    


%chk=000152533-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152533

0 1
O 5.153172 -0.828286 0.287686
N 4.341959 0.273751 -0.266900
C 0.086368 -0.258001 -0.053219
C -1.370609 -0.395583 -0.018561
C 0.676093 1.059965 -0.047262
C -2.188270 0.793725 0.022031
C -0.182740 2.224795 -0.004315
C -1.557025 2.095387 0.028684
C 0.975710 -1.375676 -0.084949
C 2.092249 1.210605 -0.073904
C -2.033666 -1.662378 -0.023885
C 2.937859 0.086578 -0.124169
C -3.611970 0.676985 0.055733
C 2.364565 -1.221140 -0.123825
C -3.432150 -1.755214 0.009693
C -4.233045 -0.577717 0.049989
H 0.283084 3.217436 0.000811
H -2.198651 2.984181 0.060008
H 0.573576 -2.393374 -0.076062
H 2.515938 2.223330 -0.064004
H -1.448098 -2.586478 -0.055085
H -4.214688 1.592830 0.086323
H 3.025098 -2.091914 -0.125752
H -3.912638 -2.739960 0.004718
H -5.325180 -0.657623 0.075973
H 4.698799 1.145426 0.149305
H 5.619362 -1.189448 -0.512360


