%chk=000073426.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073426

0 1
 O    1.227000      -2.330700      0.3686000    
 O   -1.151500      -3.752500      0.3478000    
 O    5.228500      0.3739000     -0.3154000    
 N   -2.277600       2.509200      0.2620000    
 C   -1.107800       1.805600     -0.2769000    
 C    1.102600      0.7335000      0.1525000    
 C   0.2481000       2.024700      0.4308000    
 C   -1.240100      0.3279000     -7.2899997E-02
 C  -7.1000000E-03 -0.2996000      0.1060000    
 C   -2.447200     -0.3488000     -4.7800001E-02
 C   -3.498800       1.955000     -0.3712000    
 C   -3.716400      0.4551000     -4.8400000E-02
 C    1.809400      0.8291000      -1.182200    
 C    2.061500      0.5044000       1.296700    
 C   4.2900000E-02  -1.677600      0.2316000    
 C   -2.401100      -1.734800      9.6100003E-02
 C   -2.184400       3.948200      1.9200001E-02
 C   -1.162600      -2.393500      0.2173000    
 C    3.132700      0.7147000      -1.342100    
 C    3.386900      0.3883000       1.158100    
 C    4.014800      0.4831000     -0.1776000    
 C   -1.059700      -4.515100     -0.8522000    
 H  -0.9981000       1.998200      -1.353900    
 H   0.7423000       2.940400      8.3700001E-02
 H   7.9700001E-02   2.146200       1.512100    
 H   -3.446700       2.082800      -1.461600    
 H   -4.384800       2.504600     -2.9600000E-02
 H   -4.425400      3.1599998E-02 -0.7690000    
 H   -4.162500      0.3747000      0.9511000    
 H    1.205100      0.9996000      -2.070900    
 H    1.645500      0.4233000       2.299200    
 H   -3.324000      -2.308600      0.1319000    
 H   -2.117600       4.185700      -1.048600    
 H   -1.309500       4.372500      0.5231000    
 H   -3.059300       4.463000      0.4316000    
 H    3.590800      0.7889000      -2.321500    
 H    4.031000      0.2209000       2.013500    
 H    1.954300      -1.745600      0.1040000    
 H   -1.057200      -5.575500     -0.5855000    
 H  -0.1314000      -4.286500      -1.385300    
 H   -1.921500      -4.319100      -1.498100    


%chk=000073426-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000073426

0 1
O 1.077122 -2.458519 0.296838
O -1.467407 -3.801485 0.202112
O 5.264521 0.323756 -0.464432
N -2.292900 2.572443 0.300747
C -1.129703 1.866720 -0.286072
C 1.048459 0.703403 0.079582
C 0.241809 2.040032 0.424157
C -1.339580 0.373099 -0.192899
C -0.121393 -0.309164 -0.026533
C -2.580720 -0.274180 -0.151976
C -3.532353 2.079859 -0.378849
C -3.831905 0.589899 -0.076454
C 1.740747 0.836502 -1.265400
C 2.013312 0.366280 1.195235
C -0.098528 -1.714437 0.087030
C -2.564020 -1.686969 -0.055323
C -2.166425 4.042704 0.201386
C -1.349960 -2.411041 0.035476
C 3.088577 0.707265 -1.442941
C 3.364005 0.244439 1.020954
C 4.003215 0.420704 -0.311835
C -0.599584 -4.671821 -0.620470
H -1.015507 2.169939 -1.366054
H 0.808971 2.933587 0.113624
H 0.066182 2.080886 1.515759
H -3.447075 2.222348 -1.488296
H -4.379029 2.700273 -0.033322
H -4.615247 0.231926 -0.772878
H -4.251365 0.508531 0.945612
H 1.086222 1.040913 -2.123114
H 1.566311 0.242552 2.191617
H -3.491203 -2.269473 -0.023105
H -2.086902 4.406278 -0.855042
H -1.269226 4.380000 0.748582
H -3.046417 4.521011 0.665619
H 3.553326 0.810369 -2.430169
H 4.037743 0.022495 1.857010
H 1.847636 -1.850138 0.451541
H -0.896528 -5.697187 -0.352769
H 0.464449 -4.502001 -0.391617
H -0.788831 -4.494598 -1.697131


