%chk=000021783.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021783

0 1
 O    3.386400      0.3354000     -2.8400000E-02
 O    1.616600       2.462500     -0.1441000    
 O    2.414100      -2.257900     -1.2300000E-02
 O   -4.930800      -1.168100     -0.3695000    
 N   -5.362200      0.9775000      0.3396000    
 C  -0.7054000     -0.3602000     -0.1776000    
 C    2.043100      0.1070000     -7.6899998E-02
 C    1.154900       1.180900     -0.1353000    
 C    1.557200      -1.200400     -6.8899997E-02
 C  -0.2194000      0.9473000     -0.1856000    
 C   0.1829000      -1.434000     -0.1192000    
 C   -2.138300     -0.6036000     -0.2302000    
 C   -3.095200      0.2962000      9.0400003E-02
 C    4.074300      0.4166000      -1.274500    
 C    1.785600       3.099200       1.120900    
 C    2.771000      -2.734300       1.283800    
 C   -4.534700     -6.4099997E-02 -1.2200000E-02
 H  -0.8779000       1.809200     -0.2516000    
 H  -0.1846000      -2.458000     -0.1119000    
 H   -2.430600      -1.600200     -0.5543000    
 H   -2.861800       1.295000      0.4418000    
 H    3.685200       1.243900      -1.876300    
 H    3.984100     -0.5242000      -1.826600    
 H    5.132500      0.6013000      -1.069900    
 H    2.509200       2.552900       1.734000    
 H   0.8272000       3.170900       1.644900    
 H    2.166100       4.109500      0.9478000    
 H    1.884500      -3.088600       1.819400    
 H    3.269200      -1.948200       1.859900    
 H    3.464100      -3.571200       1.162300    
 H   -5.015100       1.885300      0.6332000    
 H   -6.370800      0.8682000      0.3153000    


%chk=000021783-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021783

0 1
O 3.313320 0.454804 0.099720
O 1.429473 2.636566 0.290572
O 2.259342 -2.233277 -0.138031
O -5.102319 -1.346083 -0.288002
N -5.745291 0.880712 -0.141613
C -0.898722 -0.245921 -0.013029
C 1.922542 0.204848 0.102672
C 1.009812 1.296621 0.220402
C 1.401860 -1.116302 -0.009099
C -0.378402 1.066304 0.159431
C 0.013600 -1.334395 -0.080584
C -2.336302 -0.534215 -0.102799
C -3.369744 0.358405 -0.069708
C 3.976698 0.151221 -1.195565
C 2.399329 2.986903 1.352661
C 3.136153 -2.489182 1.029150
C -4.778914 -0.121400 -0.175583
H -1.034966 1.937995 0.234519
H -0.346676 -2.362666 -0.189050
H -2.624732 -1.590309 -0.210983
H -3.196583 1.437957 0.032062
H 3.571339 0.807879 -1.986640
H 3.828263 -0.909309 -1.465182
H 5.044151 0.365179 -1.034431
H 3.330192 2.407387 1.242503
H 1.951659 2.806681 2.349142
H 2.590423 4.062396 1.218530
H 2.522342 -2.729173 1.917768
H 3.780334 -1.616959 1.239910
H 3.745550 -3.361435 0.748349
H -5.507654 1.867159 -0.057566
H -6.724678 0.607408 -0.211524


