%chk=000064298.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064298

0 1
 O    7.410600     -0.6201000     -0.3222000    
 N   -1.017500      0.6940000     -0.1254000    
 N    5.392500      0.2005000      3.8300000E-02
 N    6.196000     -0.8429000     -0.3526000    
 C   -2.436000      0.3363000     -6.9300003E-02
 C   -4.264100     -0.6077000       1.381100    
 C   -4.779600       1.233700     -0.2670000    
 C   -4.240400      -1.088100      -1.096400    
 C   -2.771300     -0.2390000       1.317800    
 C   -3.284600       1.594400     -0.3232000    
 C   -2.747900     -0.7161000      -1.147500    
 C   -5.107500      0.6533000       1.120500    
 C   -4.572300      -1.654600      0.2957000    
 C   -5.084500      0.1752000      -1.342100    
 C  -0.2385000     -0.3115000      7.8100003E-02
 C    1.228100     -0.1783000      6.7100003E-02
 C    2.013200      -1.297800      0.2909000    
 C    1.795200       1.064400     -0.1661000    
 C    3.402300      -1.171500      0.2815000    
 C    3.184400       1.190900     -0.1758000    
 C    3.988000      7.2800003E-02  4.8000000E-02
 C    5.934100       1.511900      0.4686000    
 H   -4.504600      -1.015400       2.369200    
 H   -5.384200       2.129500     -0.4466000    
 H   -4.463300      -1.836700      -1.864900    
 H   -2.537000      0.4968000       2.098600    
 H   -2.193000      -1.136100       1.564100    
 H   -3.039700       2.029800      -1.300700    
 H   -3.056400       2.365800      0.4238000    
 H   -2.167800      -1.637900      -1.030400    
 H   -2.496600     -0.3243000      -2.142200    
 H   -6.175000      0.4080000       1.180400    
 H   -4.908900       1.403200       1.896100    
 H   -3.989000      -2.565400      0.4779000    
 H   -5.630600      -1.939700      0.3408000    
 H   -6.151600     -7.8699999E-02  -1.325000    
 H   -4.869500      0.5811000      -2.338200    
 H  -0.5894000      -1.339000      0.2737000    
 H    1.569700      -2.272000      0.4768000    
 H    1.192600       1.949700     -0.3473000    
 H    3.999500      -2.059400      0.4719000    
 H    3.600300       2.173000     -0.3812000    
 H    6.969300       1.426800      0.8183000    
 H    5.365200       1.924900       1.310100    
 H    5.923600       2.220800     -0.3664000    


%chk=000064298-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000064298

0 1
O 7.616219 -0.183003 0.776580
N -1.002935 0.211449 -0.152273
N 5.531858 0.415082 0.109894
N 6.361251 -0.399026 0.911504
C -2.467225 0.013723 -0.028105
C -4.512852 -1.016196 1.090818
C -4.637663 1.343368 0.175665
C -4.512808 -0.628864 -1.413607
C -2.959411 -0.935298 1.102767
C -3.088546 1.427092 0.189942
C -2.963799 -0.539729 -1.400870
C -5.112919 0.398536 1.311594
C -4.988660 -1.574630 -0.278220
C -5.113025 0.786099 -1.194327
C -0.146510 -0.419701 0.602913
C 1.310694 -0.202484 0.465347
C 2.224160 -0.941953 1.265370
C 1.834514 0.743737 -0.454110
C 3.612405 -0.754076 1.160115
C 3.220004 0.946401 -0.570632
C 4.124514 0.199158 0.235694
C 6.101889 1.423533 -0.799952
H -4.845324 -1.692414 1.903446
H -5.056565 2.356940 0.332207
H -4.843383 -1.025506 -2.393846
H -2.609889 -0.563726 2.088237
H -2.536114 -1.951176 0.960407
H -2.721850 2.101022 -0.607385
H -2.730961 1.835922 1.155884
H -2.514562 -1.537823 -1.573955
H -2.600514 0.128036 -2.205126
H -6.219836 0.341014 1.322420
H -4.795970 0.796499 2.296673
H -4.581283 -2.593625 -0.435921
H -6.093878 -1.657332 -0.289880
H -6.220049 0.737428 -1.220200
H -4.794306 1.464571 -2.010784
H -0.442215 -1.146594 1.387478
H 1.838340 -1.677406 1.982525
H 1.127551 1.310840 -1.067866
H 4.302818 -1.329221 1.779370
H 3.593074 1.683663 -1.287119
H 7.196398 1.381020 -0.675659
H 5.738912 2.432794 -0.539635
H 5.842253 1.196457 -1.848577


