%chk=000120931.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000120931

0 1
 O   -1.115500      0.3544000     -0.3107000    
 O   0.1134000      0.7370000       1.640800    
 N    2.262300     -0.4217000      0.3482000    
 N    4.974000      0.4058000     -0.2176000    
 C    2.560300      0.9298000     -0.1414000    
 C    3.263700      -1.376500     -0.1423000    
 C   0.9165000     -0.8320000     -4.7200002E-02
 C    3.971900       1.360300      0.2722000    
 C    4.675700     -0.9464000      0.2700000    
 C   0.6393000      -2.250400      0.4676000    
 C  -4.6700001E-02  0.1722000      0.5659000    
 C    6.319400      0.8159000      0.1799000    
 C  -0.7319000      -2.763400      9.5899999E-02
 C   -1.797000      -2.535100      0.9522000    
 C  -0.8989000      -3.453000      -1.094200    
 C   -1.674900       1.631800     -0.2334000    
 C   -3.063200      -3.009200      0.6092000    
 C   -2.165100      -3.927000      -1.437200    
 C   -1.175900       2.625300      -1.048900    
 C   -2.705700       1.854500      0.6546000    
 C   -3.247200      -3.705200     -0.5854000    
 C   -1.733900       3.901500     -0.9726000    
 C   -3.263900       3.130500      0.7309000    
 C  -5.8200002E-02   2.375000      -2.007100    
 C   -3.240800      0.7721000       1.533600    
 C   -2.777800       4.154000     -8.2800001E-02
 H    1.882200       1.684900      0.2658000    
 H    2.480400      0.9694000      -1.236000    
 H    3.209000      -1.487500      -1.233500    
 H    3.146800      -2.366000      0.3068000    
 H   0.8175000     -0.8010000      -1.141000    
 H    4.168500       2.352100     -0.1531000    
 H    4.023300       1.457000       1.365300    
 H    4.774000     -0.9979000       1.363100    
 H    5.392700      -1.659000     -0.1559000    
 H   0.7507000      -2.294100       1.560300    
 H    1.336200      -2.991500      6.4400002E-02
 H    7.067300      0.1256000     -0.2260000    
 H    6.437800      0.8512000       1.268900    
 H    6.554300       1.806600     -0.2246000    
 H   -1.663100      -2.003100       1.889400    
 H  -6.3600004E-02  -3.628000      -1.766100    
 H   -3.905400      -2.838300       1.273400    
 H   -2.308700      -4.468100      -2.368000    
 H   -4.233100      -4.074400     -0.8524000    
 H   -1.362400       4.707300      -1.600200    
 H   -4.077400       3.344500       1.419000    
 H   8.6499996E-02   1.314400      -2.228700    
 H  -0.2702000       2.861200      -2.966400    
 H   0.8733000       2.790800      -1.614000    
 H   -3.591800     -6.6299997E-02  0.9258000    
 H   -2.480000      0.4265000       2.238800    
 H   -4.096400       1.117600       2.124600    
 H   -3.211900       5.147800     -2.3000000E-02


%chk=000120931-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000120931

0 1
O -0.546096 0.892305 -0.637477
O -0.298028 0.622403 1.680126
N 2.346191 -0.524730 0.293291
N 5.047506 0.293672 -0.381341
C 2.691580 0.908217 0.090831
C 3.226188 -1.373800 -0.555463
C 0.902571 -0.884267 0.106605
C 4.166724 1.143707 0.453262
C 4.702782 -1.134932 -0.200793
C 0.564653 -2.132826 0.977512
C -0.020301 0.272802 0.517434
C 6.479214 0.564139 -0.152815
C -0.791587 -2.757602 0.682218
C -1.797863 -2.809181 1.679768
C -1.075310 -3.316966 -0.592483
C -1.486666 1.984105 -0.523806
C -3.053029 -3.404084 1.415959
C -2.329099 -3.908474 -0.862561
C -1.043897 3.252761 -0.972746
C -2.809601 1.724948 -0.088229
C -3.324231 -3.954454 0.142396
C -1.985373 4.311144 -0.962197
C -3.714378 2.816595 -0.093357
C 0.380189 3.472729 -1.443965
C -3.250596 0.346825 0.357368
C -3.309647 4.098965 -0.520961
H 2.062173 1.526849 0.754428
H 2.525640 1.232699 -0.964761
H 3.076164 -1.150186 -1.641381
H 2.983544 -2.438791 -0.389568
H 0.683530 -1.092309 -0.965760
H 4.421402 2.204931 0.271368
H 4.305435 0.935179 1.544830
H 4.879679 -1.473938 0.852081
H 5.342061 -1.742260 -0.869199
H 0.631215 -1.819753 2.033487
H 1.363399 -2.878994 0.808936
H 7.088166 -0.051249 -0.839516
H 6.811351 0.345898 0.894237
H 6.695065 1.626837 -0.364663
H -1.593931 -2.376424 2.666540
H -0.306631 -3.299511 -1.375881
H -3.816522 -3.436811 2.201592
H -2.529537 -4.336628 -1.851455
H -4.296261 -4.416129 -0.064631
H -1.671259 5.303839 -1.304707
H -4.745352 2.648016 0.238393
H 0.691326 2.696600 -2.165056
H 0.484866 4.460792 -1.922854
H 1.093229 3.430034 -0.599333
H -2.896978 -0.442746 -0.329863
H -2.841156 0.107011 1.355370
H -4.350262 0.287042 0.415453
H -4.025850 4.927903 -0.519762


