%chk=000038361.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038361

0 1
 O   -1.328600      -2.725900     -0.9904000    
 O    2.487100       2.376700      -1.162400    
 O    4.744300       2.503800      0.4539000    
 N   7.4500002E-02  -1.698600      0.5572000    
 C   -1.970600     -0.6165000     -6.9200002E-02
 C   -4.164000      0.4160000     -0.7727000    
 C   -2.176600       1.890100     -0.2848000    
 C   -3.346200      0.6860000       1.598200    
 C   -3.221300     -0.7863000     -0.9547000    
 C   -1.241700      0.6819000     -0.4687000    
 C   -2.406400     -0.5173000       1.405900    
 C   -3.422300       1.704500      -1.168400    
 C   -4.585700      0.5078000      0.7041000    
 C   -2.609400       1.973500       1.189400    
 C   -1.055100      -1.795100     -0.2371000    
 C    1.101700      -2.714200      0.5975000    
 C    2.182200      -2.442200     -0.4498000    
 C    2.864500      -1.119000     -0.2103000    
 C    2.355200      2.6500000E-02 -0.8028000    
 C    3.990200      -1.069900      0.5981000    
 C    2.986800       1.250500     -0.5817000    
 C    4.621600      0.1538000      0.8192000    
 C    4.119900       1.314000      0.2294000    
 H   -5.050800      0.2904000      -1.403900    
 H   -1.654100       2.809900     -0.5705000    
 H   -3.653900      0.7522000       2.647700    
 H   -3.754400      -1.711700     -0.6990000    
 H   -2.937300     -0.8732000      -2.012000    
 H  -0.9085000      0.6252000      -1.513000    
 H  -0.3441000      0.8513000      0.1361000    
 H   -1.554400     -0.3993000       2.085600    
 H   -2.915800      -1.440100       1.714500    
 H   -3.128800       1.658400      -2.224300    
 H   -4.089600       2.568400      -1.060600    
 H   -5.273100       1.351000      0.8452000    
 H   -5.130000     -0.3990000      0.9952000    
 H   -1.731000       2.121600       1.829600    
 H   -3.262500       2.841900       1.339000    
 H   0.2207000     -0.8877000       1.148300    
 H    1.521500      -2.713700       1.609300    
 H   0.6463000      -3.693400      0.4153000    
 H    1.748800      -2.455400      -1.458400    
 H    2.923700      -3.250500     -0.4300000    
 H    1.485600     -2.1299999E-02  -1.451200    
 H    4.387000      -1.967700       1.063300    
 H    5.503000      0.1892000       1.453800    
 H    3.045700       3.129400     -0.9010000    
 H    5.507900       2.355500       1.037700    


%chk=000038361-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000038361

0 1
O -1.456288 -2.910713 -0.721657
O 2.817605 2.486127 -1.057206
O 4.953144 2.532467 0.593135
N 0.117469 -1.695709 0.474659
C -2.065818 -0.611291 -0.008169
C -4.316077 0.348008 -0.726099
C -2.350220 1.903331 -0.365703
C -3.462200 0.781013 1.620238
C -3.343452 -0.852468 -0.861551
C -1.375407 0.702654 -0.502307
C -2.490128 -0.421807 1.487774
C -3.617350 1.643265 -1.222254
C -4.728473 0.520460 0.760925
C -2.756586 2.072476 1.123675
C -1.123967 -1.834237 -0.132627
C 1.145581 -2.742955 0.436773
C 2.285454 -2.444068 -0.584694
C 3.037403 -1.157749 -0.277518
C 2.599768 0.076522 -0.827188
C 4.157057 -1.158497 0.593389
C 3.260419 1.277225 -0.509152
C 4.830812 0.044497 0.915223
C 4.379648 1.257203 0.364445
H -5.217376 0.152915 -1.340204
H -1.840224 2.820770 -0.719835
H -3.749478 0.898075 2.684208
H -3.828490 -1.790987 -0.536217
H -3.056369 -1.001957 -1.919849
H -1.065669 0.583393 -1.559894
H -0.456774 0.921904 0.079945
H -1.597594 -0.253085 2.124198
H -2.977085 -1.348734 1.850429
H -3.339297 1.538584 -2.290239
H -4.310353 2.505281 -1.146329
H -5.438278 1.365755 0.865027
H -5.248088 -0.391109 1.118344
H -1.858953 2.279418 1.741681
H -3.435425 2.941628 1.233849
H 0.370451 -0.793053 0.879410
H 1.576949 -2.866241 1.448774
H 0.633727 -3.678789 0.153489
H 1.836074 -2.401358 -1.593408
H 2.980396 -3.305738 -0.569933
H 1.752067 0.115470 -1.518884
H 4.513623 -2.103713 1.018052
H 5.700424 0.029346 1.584482
H 3.408943 3.217442 -0.736452
H 5.750403 2.480530 1.171845


