%chk=000133277.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133277

0 1
 O    4.021800      8.5100003E-02  -1.706400    
 N   -1.211900     -0.5714000     -6.8499997E-02
 C  -0.5445000      0.7271000      2.2100000E-02
 C  -0.8769000       1.495900      -1.288700    
 C   -1.151300       1.522200       1.213500    
 C   -2.362400       1.826700      -1.458300    
 C   -2.633600       1.867100       1.042800    
 C  -0.6668000      -1.352300      -1.187900    
 C   -1.087600      -1.302900       1.200000    
 C   -2.899300       2.602600     -0.2633000    
 C   0.9656000      0.5137000      0.2482000    
 C   -1.387800      -2.693900      -1.327300    
 C   -1.822500      -2.642900       1.138600    
 C   -1.332000      -3.491200     -2.9100001E-02
 C    1.817500      0.3953000     -0.8455000    
 C    1.465700      0.4408000       1.544400    
 C    3.183600      0.2022000     -0.6407000    
 C    2.831700      0.2476000       1.749300    
 C    3.690700      0.1284000      0.6567000    
 H  -0.5220000       1.036000      -2.213500    
 H  -0.3351000       2.454100      -1.255600    
 H  -0.6088000       2.477600       1.290300    
 H   -1.039300       1.076600       2.203900    
 H   -2.943000      0.9076000      -1.599600    
 H   -2.498500       2.425700      -2.366400    
 H   -2.958000       2.495000       1.881000    
 H   -3.240500      0.9550000       1.083400    
 H   0.3892000      -1.607900      -1.062200    
 H  -0.7934000     -0.8703000      -2.158800    
 H   -1.549100     -0.7852000       2.042900    
 H  -5.3199999E-02  -1.542500       1.462700    
 H   -2.427400       3.592300     -0.2278000    
 H   -3.975900       2.768100     -0.3828000    
 H  -0.9359000      -3.278100      -2.137200    
 H   -2.435600      -2.520800      -1.604800    
 H   -2.900800      -2.466400       1.033700    
 H   -1.679100      -3.190600       2.077200    
 H   -1.941300      -4.397300     -0.1178000    
 H  -0.3005000      -3.813100      0.1595000    
 H    1.465800      0.4481000      -1.869900    
 H   0.8544000      0.5122000       2.434900    
 H    3.227100      0.1866000       2.759100    
 H    4.752800     -2.2900000E-02  0.8298000    
 H    4.929300     -4.3800000E-02  -1.380900    


%chk=000133277-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133277

0 1
O 4.156821 0.461089 -1.795961
N -1.096403 -0.633086 -0.010477
C -0.467270 0.750873 0.050144
C -0.804319 1.524887 -1.266925
C -1.119899 1.587878 1.199151
C -2.323236 1.703561 -1.488441
C -2.645403 1.768159 1.028462
C -0.630056 -1.497234 -1.129009
C -1.117189 -1.410370 1.256943
C -2.980385 2.459540 -0.312227
C 1.071137 0.634636 0.266559
C -1.568147 -2.709691 -1.321809
C -2.075669 -2.617160 1.147285
C -1.671493 -3.538894 -0.023436
C 1.969356 0.633431 -0.829627
C 1.616480 0.427431 1.567105
C 3.354111 0.438666 -0.636600
C 3.000714 0.234597 1.754306
C 3.889024 0.237221 0.656195
H -0.366804 1.035926 -2.155079
H -0.318266 2.518871 -1.196180
H -0.627717 2.581169 1.189344
H -0.908170 1.158351 2.193719
H -2.791308 0.705679 -1.586917
H -2.494407 2.247535 -2.438281
H -3.042525 2.360428 1.876454
H -3.136709 0.776821 1.058120
H 0.410608 -1.868221 -0.951277
H -0.609015 -0.909340 -2.061047
H -1.456767 -0.760901 2.080614
H -0.097343 -1.785682 1.526342
H -2.602625 3.503504 -0.289946
H -4.077128 2.516230 -0.454198
H -1.188234 -3.332092 -2.155549
H -2.573533 -2.342569 -1.607716
H -3.105332 -2.242183 0.984702
H -2.068264 -3.173564 2.105162
H -2.398588 -4.364721 -0.142022
H -0.686800 -4.001655 0.196102
H 1.625932 0.792933 -1.854933
H 0.964908 0.426977 2.445403
H 3.395740 0.083073 2.765237
H 4.966566 0.089567 0.805468
H 5.108807 0.324431 -1.564160


