%chk=000095812.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095812

0 1
 O   -2.276500     -0.1492000      8.4399998E-02
 O    3.634800      0.1435000      -1.980000    
 N    4.120500      0.1526000      0.3067000    
 C  -0.1863000      -1.255500     -0.2566000    
 C  -0.3004000       1.157500     -0.2269000    
 C  -0.9312000     -8.2900003E-02 -0.1314000    
 C  -0.8435000      -2.592600     -0.1572000    
 C   -1.080800       2.423800     -9.4899997E-02
 C    1.820100      5.2600000E-02 -0.5726000    
 C    1.189400      -1.187800     -0.4771000    
 C    1.075200       1.225300     -0.4475000    
 C  -0.8733000      -3.118100       1.284200    
 C   -1.158200       2.907900       1.359100    
 C    3.254500      0.1243000     -0.8018000    
 C   -1.573800      -4.464000       1.382800    
 C   -1.925200       4.215000       1.481300    
 C   -3.115500     -0.1748000      -1.067600    
 C    3.625700      0.1284000       1.681400    
 C    5.568000      0.2081000      0.1583000    
 C   -4.534900     -0.3053000     -0.6248000    
 C   -5.488700      0.5911000     -0.8998000    
 H   -1.859200      -2.576200     -0.5620000    
 H  -0.3045000      -3.309500     -0.7914000    
 H   -2.091000       2.324900     -0.5016000    
 H  -0.6100000       3.202700     -0.7101000    
 H    1.773500      -2.100500     -0.5725000    
 H    1.570500       2.191100     -0.5197000    
 H   0.1491000      -3.215500       1.669200    
 H   -1.389000      -2.400800       1.934400    
 H   -1.645300       2.147500       1.981500    
 H  -0.1481000       3.047500       1.763100    
 H   -1.577900      -4.814400       2.419600    
 H   -1.064900      -5.215900      0.7714000    
 H   -2.612300      -4.390600       1.044600    
 H   -1.964600       4.535400       2.527100    
 H   -2.952800       4.100900       1.121600    
 H   -1.443300       5.007900      0.9005000    
 H   -2.867100      -1.029600      -1.706300    
 H   -2.970200      0.7299000      -1.668200    
 H    3.978800       1.030600       2.190400    
 H    2.540000      8.9400001E-02   1.764500    
 H    4.042500     -0.7512000       2.181700    
 H    6.006800     -0.6723000      0.6363000    
 H    5.939100       1.115700      0.6429000    
 H    5.854200      0.2228000     -0.8963000    
 H   -4.799100      -1.188500     -4.9100000E-02
 H   -6.504000      0.4373000     -0.5507000    
 H   -5.277200       1.487700      -1.471800    


%chk=000095812-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000095812

0 1
O -2.287976 -0.122127 0.079579
O 3.851276 -1.157225 -1.506589
N 4.290747 0.428506 0.143211
C -0.234071 -1.435222 -0.235721
C -0.141023 1.047226 -0.070655
C -0.871989 -0.171013 -0.097206
C -1.022046 -2.733352 -0.166725
C -0.839984 2.378455 0.151541
C 1.934912 -0.261365 -0.343471
C 1.172185 -1.453375 -0.376285
C 1.267076 0.979098 -0.194748
C -1.364904 -3.135944 1.295817
C -1.150384 2.637396 1.653526
C 3.417246 -0.367415 -0.603322
C -2.156662 -4.458184 1.367955
C -1.876747 3.980297 1.876049
C -3.060902 -0.068942 -1.196929
C 3.962534 1.096930 1.412803
C 5.718208 0.433706 -0.221216
C -4.512233 -0.274081 -0.857768
C -5.514038 0.540042 -1.270802
H -1.971545 -2.652678 -0.729062
H -0.436009 -3.546092 -0.637593
H -1.797044 2.415625 -0.401199
H -0.207371 3.201633 -0.234688
H 1.693606 -2.405055 -0.527754
H 1.840288 1.914007 -0.203656
H -0.424614 -3.227839 1.874121
H -1.948410 -2.317958 1.758716
H -1.772190 1.804162 2.030716
H -0.203169 2.619439 2.228477
H -2.388340 -4.729723 2.414137
H -1.583737 -5.292848 0.921034
H -3.115274 -4.378716 0.820344
H -2.086593 4.149739 2.948011
H -2.842449 3.999695 1.336560
H -1.269724 4.830991 1.511303
H -2.691460 -0.872484 -1.868868
H -2.895990 0.905013 -1.699864
H 4.026101 2.199665 1.322631
H 2.949743 0.827865 1.744380
H 4.680605 0.777356 2.193961
H 6.322281 -0.116932 0.527337
H 6.091286 1.473715 -0.279551
H 5.831337 -0.062487 -1.196546
H -4.729757 -1.161200 -0.246907
H -6.560929 0.328644 -1.027613
H -5.317964 1.439253 -1.868372


