%chk=000133456.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133456

0 1
 O    4.217700     -0.7404000      0.4549000    
 O    3.077300       2.623500      0.4854000    
 O    4.197700     -0.6461000      -1.862300    
 N    3.217500      0.2836000      0.4505000    
 C   -1.505800       1.428900     -0.7865000    
 C   -2.705900      0.5634000     -0.4639000    
 C  -0.3722000      0.6179000     -0.1943000    
 C   -2.304100     -0.6008000      0.2288000    
 C  -0.8670000     -0.5673000      0.3949000    
 C   -4.034900      0.8024000     -0.7663000    
 C   0.9783000      0.9196000     -0.1873000    
 C   -3.240000      -1.541100      0.6263000    
 C   -4.978100     -0.1455000     -0.3655000    
 C  -4.0000002E-03  -1.465400       1.000100    
 C    1.848100      1.4100000E-02  0.4230000    
 C   -4.584700      -1.305600      0.3237000    
 C    1.361900      -1.166500       1.010800    
 C   -6.422400      7.4699998E-02 -0.6719000    
 C   -7.147900      0.8353000      0.4323000    
 C    3.746000       1.589200      0.4764000    
 C    5.255100       1.707700      0.5045000    
 C    4.612000      -1.105300     -0.8063000    
 C    5.655400      -2.176400     -0.7070000    
 H   -1.383400       1.533600      -1.868400    
 H   -1.585500       2.401600     -0.2927000    
 H   -4.327600       1.702200      -1.297300    
 H    1.305600       1.813300     -0.7042000    
 H   -2.951700      -2.440900       1.159300    
 H  -0.3645000      -2.380000       1.458800    
 H   -5.328400      -2.036600      0.6329000    
 H    2.043100      -1.866800       1.489200    
 H   -6.523500      0.6227000      -1.617300    
 H   -6.920000     -0.8893000     -0.8366000    
 H   -7.104900      0.2914000       1.381900    
 H   -8.200700      0.9744000      0.1672000    
 H   -6.703200       1.823800      0.5904000    
 H    5.532000       2.743300      0.7260000    
 H    5.671100       1.442300     -0.4701000    
 H    5.681800       1.073700       1.286100    
 H    5.967200      -2.473000      -1.712500    
 H    6.527600      -1.795100     -0.1701000    
 H    5.241600      -3.051100     -0.1990000    


%chk=000133456-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133456

0 1
O 4.206581 -0.640124 0.515993
O 3.266046 2.845147 0.409156
O 4.294601 -0.645574 -1.850697
N 3.327405 0.526276 0.422372
C -1.544353 1.544710 -0.752525
C -2.724805 0.619731 -0.475476
C -0.358636 0.757285 -0.206962
C -2.268937 -0.574180 0.163854
C -0.807684 -0.487897 0.330044
C -4.087287 0.800412 -0.763082
C 0.995920 1.115536 -0.194157
C -3.190768 -1.586057 0.512197
C -5.026881 -0.208626 -0.414113
C 0.125125 -1.382852 0.897280
C 1.927033 0.207608 0.383277
C -4.559520 -1.392939 0.219990
C 1.489877 -1.030079 0.930409
C -6.513935 -0.006329 -0.670531
C -7.233382 0.667408 0.530010
C 3.955838 1.785620 0.422526
C 5.476414 1.778324 0.444119
C 4.583610 -1.187347 -0.777934
C 5.338410 -2.471333 -0.536217
H -1.432845 1.763558 -1.832584
H -1.653687 2.522239 -0.243182
H -4.437131 1.715110 -1.258612
H 1.341413 2.069311 -0.594956
H -2.856300 -2.510410 0.997030
H -0.196828 -2.340046 1.321717
H -5.284139 -2.173944 0.482685
H 2.221502 -1.702614 1.386227
H -6.658814 0.619651 -1.572081
H -6.996629 -0.980772 -0.877181
H -7.134435 0.052846 1.443128
H -8.310322 0.803547 0.319836
H -6.795002 1.658816 0.744710
H 5.809911 2.819369 0.564440
H 5.880605 1.384104 -0.505921
H 5.873018 1.160416 1.267221
H 6.111082 -2.597260 -1.310464
H 5.790160 -2.489075 0.467070
H 4.634368 -3.320165 -0.614716


