%chk=000167654.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000167654

0 1
 O    2.173500     -0.4024000     -0.1482000    
 O    4.194500      0.4399000      -1.057400    
 O  -0.7919000     -0.1435000     -0.3220000    
 O   0.5568000      -2.822300      -2.317600    
 O    3.638500      -2.020800       1.615100    
 O   0.4444000      -2.230400       1.265000    
 O    5.400500     -8.9400001E-02   2.856200    
 O   -2.212100      -1.659800      0.7598000    
 O    4.974600       2.567400       1.850100    
 O   -1.612500       1.040900      -2.679100    
 O    4.109300       2.854200      -2.328800    
 O   -7.521500       1.447000     -0.4809000    
 O   -7.012100       2.320400       1.467700    
 N   -6.769600       1.534700      0.5198000    
 C    1.380300     -0.7954000      -1.272600    
 C    1.009000      -2.272100      -1.084400    
 C   0.1610000      0.1392000      -1.354800    
 C    3.559700     -0.6464000     -0.3799000    
 C    4.317500     -0.9926000      0.9028000    
 C  -9.3800001E-02  -2.453900     -3.9000001E-02
 C    4.481300      0.2267000       1.808100    
 C    5.042300       1.411200       1.018800    
 C    4.251700       1.639200     -0.2767000    
 C   -1.257100      -1.491100     -0.2860000    
 C  -0.5048000      0.1606000      -2.729300    
 C    4.888400       2.712800      -1.155200    
 C   -3.331300     -0.8748000      0.7008000    
 C   -4.177400     -0.9610000     -0.4002000    
 C   -3.614900      2.3000001E-03   1.742800    
 C   -5.319100     -0.1617000     -0.4600000    
 C   -4.756600      0.8015000       1.683200    
 C   -5.608600      0.7195000      0.5818000    
 H    1.957600     -0.6606000      -2.197700    
 H    1.888600      -2.847100     -0.7739000    
 H   0.4980000       1.161200      -1.138100    
 H    3.666900      -1.520300      -1.034600    
 H    5.313300      -1.376300      0.6486000    
 H  -0.4698000      -3.483900     -5.1700000E-02
 H    3.530100      0.4838000       2.290500    
 H    6.099500       1.230200      0.7853000    
 H    3.225200       1.957500     -5.0600000E-02
 H   -1.728900      -1.749900      -1.239900    
 H   0.1892000      0.5077000      -3.501400    
 H  -0.8842000     -0.8171000      -3.032400    
 H    5.902500       2.432200      -1.458700    
 H    4.927700       3.679700     -0.6454000    
 H   0.3687000      -3.764700      -2.169700    
 H    2.734400      -1.710100       1.793900    
 H  -0.2869000      -2.317300       1.900200    
 H    5.388800      0.6467000       3.490900    
 H    5.603600       2.444200       2.580700    
 H   -1.277900       1.925700      -2.454400    
 H    4.076500       1.986600      -2.767000    
 H   -3.977900      -1.653800      -1.212400    
 H   -2.953300      6.9300003E-02   2.601800    
 H   -5.961700     -0.2547000      -1.331800    
 H   -4.950000       1.476800       2.512700    


%chk=000167654-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000167654

0 1
O 2.321113 -0.230114 -0.517538
O 4.541008 0.419565 -1.182004
O -0.658338 0.037564 -0.518378
O 0.471821 -3.015112 -2.115085
O 3.368796 -1.893207 1.557512
O 0.652732 -1.814866 1.406176
O 4.717581 0.259608 3.033675
O -1.963427 -1.156585 0.996018
O 4.962007 2.795513 1.680822
O -1.818712 0.471236 -3.070607
O 4.886782 2.804717 -2.631887
O -7.559096 1.719676 -0.189348
O -7.789554 1.183402 2.017251
N -7.118338 1.204496 0.911738
C 1.442148 -0.884941 -1.494368
C 1.041300 -2.291189 -0.964446
C 0.235182 0.055943 -1.699687
C 3.736859 -0.615242 -0.559176
C 4.171914 -0.869398 0.901432
C -0.010104 -2.248462 0.174655
C 4.157792 0.453147 1.691567
C 5.032685 1.503783 0.995077
C 4.529421 1.726908 -0.441732
C -1.156035 -1.292594 -0.200323
C -0.531012 -0.229097 -3.018448
C 5.415601 2.654213 -1.273327
C -3.225677 -0.531791 0.896803
C -3.722154 0.051087 -0.296133
C -3.986216 -0.538694 2.091177
C -5.011101 0.616151 -0.284060
C -5.267292 0.034378 2.101671
C -5.769020 0.603665 0.907840
H 1.970164 -1.029115 -2.460477
H 1.949025 -2.796717 -0.577881
H 0.611651 1.094590 -1.697208
H 3.887362 -1.511384 -1.189699
H 5.201177 -1.271383 0.894620
H -0.427923 -3.265736 0.324919
H 3.114636 0.829713 1.760591
H 6.079662 1.126936 0.980297
H 3.490046 2.105451 -0.422466
H -1.755825 -1.708040 -1.035632
H 0.121174 0.066212 -3.867310
H -0.777007 -1.294643 -3.131767
H 6.454398 2.260497 -1.289069
H 5.416527 3.659507 -0.826330
H 0.535124 -3.991177 -1.966843
H 2.379187 -1.685471 1.497661
H -0.006736 -1.337812 1.972863
H 4.315440 -0.568344 3.406484
H 5.114778 2.622224 2.645952
H -1.671592 1.447582 -2.984465
H 4.778995 1.889037 -2.998817
H -3.117741 0.097073 -1.209186
H -3.563800 -0.997348 2.989594
H -5.434243 1.073654 -1.182134
H -5.883149 0.046632 3.004235


