%chk=000065631.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065631

0 1
 O    1.227000      -2.330400      0.3686000    
 O   -1.151100      -3.752400      0.3479000    
 O    5.228400      0.3741000     -0.3153000    
 N   -2.277700       2.509000      0.2619000    
 C   -1.107900       1.805500     -0.2769000    
 C    1.102600      0.7335000      0.1525000    
 C   0.2480000       2.024700      0.4308000    
 C   -1.240100      0.3278000     -7.2899997E-02
 C  -7.1000000E-03 -0.2996000      0.1059000    
 C   -2.447200     -0.3489000     -4.7800001E-02
 C   -3.498900       1.954800     -0.3712000    
 C   -3.716500      0.4549000     -4.8400000E-02
 C    1.809300      0.8292000      -1.182200    
 C    2.061400      0.5045000       1.296800    
 C   4.2900000E-02  -1.677600      0.2316000    
 C   -2.401100      -1.734900      9.6100003E-02
 C   -2.184600       3.948100      1.9200001E-02
 C   -1.162500      -2.393600      0.2173000    
 C    3.132600      0.7149000      -1.342100    
 C    3.386900      0.3885000       1.158100    
 C    4.014700      0.4832000     -0.1776000    
 C   -1.059100      -4.515200     -0.8522000    
 H  -0.9982000       1.998100      -1.353900    
 H   0.7421000       2.940500      8.3700001E-02
 H   7.9499997E-02   2.146100       1.512100    
 H   -3.446800       2.082700      -1.461500    
 H   -4.384900       2.504500     -2.9500000E-02
 H   -4.425400      3.1399999E-02 -0.7690000    
 H   -4.162500      0.3745000      0.9511000    
 H    1.205000      0.9997000      -2.070800    
 H    1.645500      0.4234000       2.299200    
 H   -3.323900      -2.308700      0.1319000    
 H   -2.117900       4.185700      -1.048600    
 H   -1.309700       4.372400      0.5232000    
 H   -3.059500       4.462800      0.4317000    
 H    3.590800      0.7891000      -2.321500    
 H    4.031000      0.2211000       2.013500    
 H    1.954300      -1.745400      0.1037000    
 H   -1.056400      -5.575600     -0.5855000    
 H  -0.1308000      -4.286500      -1.385200    
 H   -1.920800      -4.319300      -1.498200    


%chk=000065631-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000065631

0 1
O 1.077317 -2.458434 0.296832
O -1.467128 -3.801572 0.202082
O 5.264530 0.324140 -0.464406
N -2.293044 2.572298 0.300764
C -1.129798 1.866658 -0.286055
C 1.048441 0.703484 0.079599
C 0.241698 2.040057 0.424182
C -1.339575 0.373022 -0.192895
C -0.121343 -0.309160 -0.026529
C -2.580672 -0.274341 -0.151980
C -3.532459 2.079636 -0.378846
C -3.831914 0.589656 -0.076458
C 1.740722 0.836642 -1.265381
C 2.013314 0.366419 1.195252
C -0.098383 -1.714432 0.087025
C -2.563876 -1.687129 -0.055341
C -2.166668 4.042569 0.201415
C -1.349768 -2.411121 0.035458
C 3.088562 0.707503 -1.442919
C 3.364016 0.244675 1.020973
C 4.003216 0.421004 -0.311811
C -0.599240 -4.671851 -0.620491
H -1.015618 2.169893 -1.366034
H 0.808802 2.933652 0.113658
H 0.066066 2.080889 1.515783
H -3.447180 2.222134 -1.488291
H -4.379180 2.699992 -0.033326
H -4.615231 0.231633 -0.772885
H -4.251372 0.508256 0.945606
H 1.086185 1.041013 -2.123095
H 1.566319 0.242648 2.191630
H -3.491020 -2.269696 -0.023133
H -2.087166 4.406157 -0.855009
H -1.269493 4.379920 0.748616
H -3.046693 4.520813 0.665650
H 3.553308 0.810647 -2.430144
H 4.037767 0.022768 1.857029
H 1.847788 -1.850000 0.451544
H -0.896142 -5.697235 -0.352812
H 0.464778 -4.501981 -0.391606
H -0.788467 -4.494623 -1.697154


