%chk=000158140.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000158140

0 1
 O   2.8899999E-02 -0.8643000     -0.1783000    
 O    1.736200      -2.415900     -1.6400000E-02
 N   -6.158600       3.041600     -0.4678000    
 C    2.726600      0.7057000      0.6903000    
 C    3.650900     -0.2707000      4.6999998E-02
 C    2.247100     -0.1545000     -0.4421000    
 C    2.278800      0.3931000       2.078600    
 C    2.870200       2.167700      0.4261000    
 C    4.730800      0.2144000     -0.8333000    
 C    1.325800      -1.277100     -0.1884000    
 C    5.966800      0.6144000     -0.4777000    
 C    6.958000       1.084700      -1.505500    
 C    6.464200      0.6302000      0.9401000    
 C  -0.9399000      -1.890200      6.1000001E-02
 C   -2.311700      -1.282400      4.1999999E-02
 C   -3.015700      -1.210200      -1.154700    
 C   -2.866000     -0.7976000       1.221100    
 C   -4.291100     -0.6455000      -1.172500    
 C   -4.141400     -0.2330000       1.203300    
 C   -4.853800     -0.1569000      6.5000001E-03
 C   -6.217000      0.4473000     -1.2500000E-02
 C   -6.189100       1.899200     -0.2667000    
 H    3.923500      -1.159900      0.6071000    
 H    2.081100      0.3345000      -1.398300    
 H    2.939900      0.8716000       2.809700    
 H    1.263000      0.7668000       2.248200    
 H    2.280100     -0.6795000       2.301100    
 H    3.681600       2.590600       1.028500    
 H    3.076400       2.398300     -0.6248000    
 H    1.946800       2.694800      0.6911000    
 H    4.486600      0.2335000      -1.894600    
 H    7.258600       2.116700      -1.297100    
 H    7.851300      0.4518000      -1.488000    
 H    6.550200       1.056300      -2.521400    
 H    7.342900     -1.5600000E-02   1.038900    
 H    6.747700       1.647700       1.228600    
 H    5.716300      0.2812000       1.657900    
 H  -0.7473000      -2.361500       1.033000    
 H  -0.8575000      -2.665100     -0.7115000    
 H   -2.585700      -1.585600      -2.079100    
 H   -2.318600     -0.8495000       2.158200    
 H   -4.834800     -0.5908000      -2.112000    
 H   -4.567600      0.1457000       2.128600    
 H   -6.724300      0.2515000      0.9406000    
 H   -6.832500     -4.6799999E-02 -0.7749000    


%chk=000158140-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000158140

0 1
O -0.145221 0.431427 2.274391
O 1.054485 -1.480404 1.653714
N -3.900839 -2.484727 -4.295434
C 3.592104 0.412950 2.153527
C 3.259046 0.380458 0.653992
C 2.131357 0.724812 1.693363
C 3.900241 -0.914414 2.843597
C 4.364723 1.597880 2.733223
C 3.712219 1.403904 -0.321908
C 1.019508 -0.237179 1.855896
C 3.928896 1.217389 -1.659041
C 4.405154 2.365893 -2.533384
C 3.729653 -0.095719 -2.394705
C -1.375921 -0.422284 2.438601
C -2.182163 -0.480324 1.159541
C -1.911737 -1.466120 0.177863
C -3.222905 0.452536 0.919862
C -2.659877 -1.514965 -1.018729
C -3.970832 0.404586 -0.273678
C -3.695668 -0.580994 -1.254860
C -4.541257 -0.589805 -2.535085
C -4.185026 -1.637777 -3.505232
H 3.143771 -0.637124 0.263373
H 1.826494 1.772366 1.765721
H 4.970645 -1.162232 2.713535
H 3.697472 -0.848061 3.929653
H 3.296465 -1.740593 2.433627
H 5.450681 1.465455 2.567833
H 4.069928 2.562014 2.284072
H 4.191689 1.669271 3.823036
H 3.888718 2.411816 0.081818
H 5.370281 2.121550 -3.020980
H 3.682693 2.568552 -3.349303
H 4.540019 3.296958 -1.955840
H 3.007191 0.032859 -3.224965
H 4.680123 -0.432636 -2.854592
H 3.357922 -0.908559 -1.751140
H -1.924170 0.088190 3.246097
H -1.052600 -1.426953 2.760850
H -1.102009 -2.182674 0.352870
H -3.444228 1.221551 1.669718
H -2.436851 -2.283091 -1.767702
H -4.773215 1.134035 -0.442033
H -4.457587 0.390441 -3.045064
H -5.611672 -0.713559 -2.276199


