%chk=000166530.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000166530

0 1
 O   0.5754000     -0.8774000     -0.5779000    
 O  -0.4229000       1.455900      0.5550000    
 O    1.004300      -1.720500       1.552600    
 O  -0.7473000       2.323400      -1.585100    
 N    7.301100      0.3666000      0.2152000    
 C    3.620100       1.130500     -0.3306000    
 C    5.073000       1.017700     -0.6476000    
 C    2.762500      6.4499997E-02 -0.6024000    
 C    5.878500      0.4476000      0.5285000    
 C    1.403600      0.1697000     -0.3063000    
 C    3.118800       2.301700      0.2372000    
 C   0.9366000       1.338000      0.2538000    
 C    1.759800       2.406900      0.5331000    
 C   0.4430000      -1.791100      0.4696000    
 C  -0.4722000      -2.900000      9.9200003E-02
 C   -1.193100       1.974100     -0.4834000    
 C   -2.592200       2.066800     -9.6900001E-02
 C  -0.2645000      -4.149200      0.6475000    
 C   -1.503800      -2.646300     -0.7814000    
 C   -3.399800       3.069900     -0.6327000    
 C   -3.126500       1.150800      0.8092000    
 C   -1.125900      -5.189800      0.3001000    
 C   -2.365300      -3.686900      -1.128700    
 C   -4.741900       3.156800     -0.2626000    
 C   -4.468500       1.237800       1.179300    
 C   -2.176400      -4.958600     -0.5880000    
 C   -5.276300       2.240700      0.6434000    
 H    5.466400       2.004500     -0.9264000    
 H    5.209200      0.3867000      -1.536100    
 H    3.148200     -0.8512000      -1.044200    
 H    5.510800     -0.5520000      0.7886000    
 H    5.749400       1.079400       1.414800    
 H    3.776800       3.138700      0.4557000    
 H    1.369900       3.318000      0.9762000    
 H    7.794200     -6.9600001E-02  0.9931000    
 H    7.439900     -0.2430000     -0.5898000    
 H   0.5516000      -4.342200       1.337500    
 H   -1.680200      -1.661700      -1.204100    
 H   -2.998600       3.793300      -1.337900    
 H   -2.525800      0.3498000       1.232100    
 H  -0.9786000      -6.180300      0.7207000    
 H   -3.185400      -3.506200      -1.817500    
 H   -5.370900       3.938000     -0.6795000    
 H   -4.885700      0.5225000       1.882100    
 H   -2.847600      -5.768700     -0.8579000    
 H   -6.321400       2.307900      0.9309000    


%chk=000166530-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000166530

0 1
O 0.761279 -0.797822 -0.635355
O -0.249250 1.566845 0.599854
O 0.487377 -1.380959 1.623745
O -0.911212 1.873678 -1.633397
N 7.568748 0.328980 0.223609
C 3.888501 1.242638 -0.372781
C 5.374902 1.103062 -0.652678
C 3.002808 0.162659 -0.617255
C 6.126628 0.406803 0.515883
C 1.637192 0.276873 -0.310082
C 3.361242 2.434129 0.188552
C 1.123762 1.473783 0.236496
C 1.987293 2.552854 0.490838
C 0.184121 -1.555822 0.426323
C -0.778507 -2.558936 -0.105679
C -1.220206 1.715666 -0.435320
C -2.597516 1.672798 0.127764
C -1.377072 -3.456557 0.817551
C -1.108574 -2.632220 -1.484478
C -3.682342 1.935846 -0.749756
C -2.843674 1.367850 1.492270
C -2.295954 -4.423790 0.364017
C -2.030517 -3.601631 -1.931854
C -5.004734 1.899365 -0.264060
C -4.169930 1.329645 1.971232
C -2.623732 -4.498243 -1.011407
C -5.250535 1.596370 1.097052
H 5.845034 2.089743 -0.812338
H 5.536536 0.511127 -1.575934
H 3.365897 -0.774656 -1.052662
H 5.641455 -0.580881 0.708267
H 5.991671 1.008982 1.433906
H 4.030908 3.279533 0.382991
H 1.573861 3.473014 0.914827
H 8.161093 0.122638 1.032489
H 7.804387 -0.252688 -0.586427
H -1.109560 -3.377526 1.876543
H -0.645765 -1.930789 -2.183742
H -3.467084 2.163738 -1.799072
H -1.998876 1.159879 2.154387
H -2.756517 -5.116946 1.076064
H -2.288567 -3.657823 -2.994759
H -5.841525 2.104752 -0.940208
H -4.362279 1.090864 3.022681
H -3.339202 -5.250050 -1.363300
H -6.279263 1.566723 1.473602


