%chk=000032578.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032578

0 1
 O   -5.959000     -2.4999999E-03  0.5671000    
 N   0.3422000     -0.3939000      9.8300003E-02
 C    2.835400     -0.3342000      0.7484000    
 C    4.109200     -9.7300000E-02 -0.1261000    
 C    3.438400       1.098200     -0.8527000    
 C    1.725700     -0.5317000     -0.3358000    
 C    2.626200       1.057500       1.414700    
 C    2.121800      0.5042000      -1.411100    
 C    3.033200       2.038500      0.3032000    
 C    2.908000      -1.463200       1.760900    
 C    5.387700      0.2764000      0.6527000    
 C    4.509800      -1.253700      -1.064700    
 C  -0.5741000     -0.5601000      -1.021800    
 C   -2.011100     -0.4112000     -0.5976000    
 C   -2.605900      0.8422000     -0.6280000    
 C   -2.720100      -1.529500     -0.1826000    
 C   -3.937200      0.9801000     -0.2349000    
 C   -4.051300      -1.391700      0.2104000    
 C   -4.659800     -0.1368000      0.1843000    
 C   -6.519000       1.308800      0.5151000    
 H    4.046200       1.590300      -1.615500    
 H    1.828800      -1.541700     -0.7538000    
 H    3.259300       1.189600       2.299100    
 H    1.594400       1.225000       1.740100    
 H    1.389000       1.304000      -1.563700    
 H    2.277900      1.7100001E-02  -2.380000    
 H    2.211700       2.710400      3.3199999E-02
 H    3.872900       2.663900      0.6243000    
 H    3.060500      -2.429300       1.269500    
 H    3.731800      -1.313600       2.466300    
 H    1.983500      -1.528300       2.344300    
 H    5.780500     -0.5943000       1.190100    
 H    6.167000      0.6199000     -3.7500001E-02
 H    5.255600       1.066900       1.394100    
 H    3.717600      -1.598300      -1.732000    
 H    5.341200     -0.9474000      -1.710700    
 H    4.842100      -2.123200     -0.4867000    
 H   0.1431000      -1.090200      0.8160000    
 H  -0.4412000      -1.550400      -1.478300    
 H  -0.3935000      0.1629000      -1.824900    
 H   -2.050400       1.718400     -0.9510000    
 H   -2.255200      -2.511000     -0.1566000    
 H   -4.347400       1.983300     -0.2791000    
 H   -4.609200      -2.265400      0.5363000    
 H   -6.544500       1.695100     -0.5095000    
 H   -6.009600       1.991500       1.203700    
 H   -7.557500       1.230500      0.8530000    


%chk=000032578-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000032578

0 1
O -6.096604 0.157235 0.268941
N 0.389367 -0.438801 -0.027950
C 2.815278 -0.242916 0.735991
C 4.153383 -0.028231 -0.095330
C 3.497725 1.054082 -1.028323
C 1.808953 -0.622051 -0.410259
C 2.471246 1.218551 1.182342
C 2.249251 0.312862 -1.596871
C 2.974048 2.108291 -0.009993
C 2.868481 -1.256743 1.885135
C 5.335785 0.503554 0.751714
C 4.669599 -1.279344 -0.850649
C -0.580309 -0.965055 -1.015810
C -2.021796 -0.653260 -0.630734
C -2.364592 0.575813 -0.019801
C -3.062706 -1.577681 -0.909261
C -3.705086 0.890621 0.300086
C -4.404154 -1.280885 -0.603187
C -4.729897 -0.041794 0.002244
C -6.483309 1.426277 0.887006
H 4.163568 1.469811 -1.805031
H 1.995430 -1.689214 -0.688399
H 2.981154 1.468721 2.130848
H 1.385253 1.326132 1.341574
H 1.443648 1.027267 -1.844748
H 2.488058 -0.262166 -2.509234
H 2.161877 2.716698 -0.446292
H 3.774110 2.802565 0.304390
H 3.098733 -2.275699 1.519311
H 3.639993 -0.977261 2.626738
H 1.905325 -1.309577 2.430007
H 5.749796 -0.300605 1.389643
H 6.152164 0.850342 0.089545
H 5.060573 1.343191 1.410845
H 3.943651 -1.696025 -1.567794
H 5.585024 -1.023886 -1.417914
H 4.939337 -2.083094 -0.139032
H 0.197613 -0.829243 0.906913
H -0.476512 -2.067436 -1.182610
H -0.344658 -0.488908 -1.989446
H -1.561348 1.284338 0.208911
H -2.821083 -2.542470 -1.372762
H -3.933887 1.851064 0.772479
H -5.210758 -1.989182 -0.816138
H -6.215753 2.287402 0.243483
H -6.014716 1.550652 1.883167
H -7.576554 1.371858 0.996757


