%chk=000021262.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021262

0 1
 O   0.4777000      -1.084100     -0.4491000    
 N   -4.648200      0.9310000      0.3188000    
 C    4.023800     -3.7000000E-03  0.3243000    
 C    2.790500     -0.9038000      0.1455000    
 C    1.552700     -0.1593000     -0.3402000    
 C    4.365400      0.6792000      -1.002100    
 C    3.821600       1.052100       1.411900    
 C  -0.7853000     -0.5878000     -0.2599000    
 C   -1.062700      0.7331000     -0.5931000    
 C   -1.776500      -1.410100      0.2636000    
 C   -3.348200      0.4196000      0.1244000    
 C   -2.348500       1.238600     -0.4002000    
 C   -3.062300     -0.9047000      0.4563000    
 H    4.866300     -0.6429000      0.6159000    
 H    2.560900      -1.407500       1.093500    
 H    3.021500      -1.711400     -0.5616000    
 H    1.317700      0.6311000      0.3813000    
 H    1.721900      0.2800000      -1.328300    
 H    5.337100       1.180300     -0.9260000    
 H    3.632500       1.442800      -1.281300    
 H    4.435100     -5.0500002E-02  -1.815600    
 H    3.072300       1.799400       1.133000    
 H    4.759500       1.585900       1.600800    
 H    3.509200      0.5865000       2.352400    
 H  -0.3220000       1.395300      -1.030800    
 H   -1.557800      -2.441800      0.5236000    
 H   -2.560800       2.270400     -0.6685000    
 H   -3.832800      -1.552900      0.8659000    
 H   -4.855600       1.891200      7.8800000E-02
 H   -5.373600      0.3381000      0.6996000    


%chk=000021262-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021262

0 1
O 0.452438 -0.980524 0.255906
N -4.921918 0.772305 -0.157783
C 4.169755 -0.027118 0.183652
C 2.853330 -0.848676 0.290711
C 1.569157 -0.036665 0.088138
C 4.371580 0.588942 -1.223314
C 4.284852 1.054825 1.286265
C -0.855911 -0.461887 0.134268
C -1.170648 0.888302 -0.151474
C -1.905838 -1.393803 0.320055
C -3.582033 0.369785 -0.063156
C -2.520480 1.295858 -0.248432
C -3.247952 -0.987157 0.223525
H 4.993884 -0.753170 0.346846
H 2.800182 -1.328749 1.287150
H 2.866646 -1.664511 -0.457894
H 1.480284 0.777015 0.837589
H 1.525938 0.410920 -0.926619
H 5.373044 1.050127 -1.309163
H 3.625489 1.379011 -1.431487
H 4.281697 -0.179284 -2.014155
H 3.541032 1.861544 1.144181
H 5.286326 1.523696 1.271858
H 4.126420 0.621102 2.291411
H -0.382805 1.632781 -0.300901
H -1.649154 -2.434835 0.540951
H -2.748849 2.345797 -0.470607
H -4.047343 -1.723900 0.371392
H -5.162507 1.737010 -0.361216
H -5.675213 0.105359 -0.024797


