%chk=000058071.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000058071

0 1
 O   0.9922000     -0.3209000      0.1303000    
 O  -0.6578000     -0.8457000      -1.378600    
 N   -4.742000      0.1862000      0.5837000    
 N   -1.116100     -0.5697000      0.8799000    
 C   -5.120300     -0.6978000     -0.5183000    
 C   -5.541100       1.396100      0.3915000    
 C   -6.631300     -0.5319000     -0.5842000    
 C   -6.907500      0.8456000      1.0400000E-02
 C   -3.313200      0.4622000      0.6092000    
 C   -2.530800     -0.8220000      0.8415000    
 C  -0.2950000     -0.6021000     -0.2325000    
 C    3.305900      3.8000001E-03 -0.3659000    
 C    1.954000     -0.3205000     -0.9305000    
 C    4.134600      -1.022600      7.9899997E-02
 C    3.724600       1.329400     -0.2891000    
 C    5.390700     -0.7211000      0.6062000    
 C    4.980700       1.631000      0.2370000    
 C    3.705900      -2.451600      7.4000000E-03
 C    2.852700       2.446000     -0.7628000    
 C    5.813700      0.6057000      0.6848000    
 H   -4.866400      -1.746400     -0.3355000    
 H   -4.670700     -0.3840000      -1.469100    
 H   -5.151000       2.015800     -0.4261000    
 H   -5.591400       2.006600       1.298500    
 H   -6.999400     -0.6109000      -1.612100    
 H   -7.135100      -1.300800      1.3400000E-02
 H   -7.548000      0.7461000      0.8946000    
 H   -7.419000       1.499900     -0.7029000    
 H   -2.980600      0.9435000     -0.3203000    
 H   -3.089600       1.164400       1.422700    
 H   -2.707600      -1.560200      5.3199999E-02
 H   -2.804100      -1.275800       1.800700    
 H  -0.6927000     -0.3476000       1.775900    
 H    1.950100      -1.295300      -1.431400    
 H    1.654800      0.4016000      -1.698700    
 H    6.053000      -1.507600      0.9583000    
 H    5.326700       2.659000      0.3042000    
 H    4.409500      -3.108800      0.5310000    
 H    3.661700      -2.787900      -1.033500    
 H    2.730900      -2.595800      0.4844000    
 H    3.271000       3.423000     -0.4954000    
 H    1.860900       2.395100     -0.3018000    
 H    2.755500       2.422600      -1.852900    
 H    6.792100      0.8404000       1.093900    


%chk=000058071-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000058071

0 1
O 1.062769 -0.441050 0.127464
O -0.554388 -1.042942 -1.489622
N -4.801055 0.154829 0.487866
N -1.105018 -0.684912 0.771075
C -5.311728 -0.508424 -0.743552
C -5.631601 1.380377 0.629831
C -6.851649 -0.346653 -0.639456
C -7.064067 0.895400 0.292979
C -3.348861 0.405068 0.515408
C -2.548424 -0.914663 0.631530
C -0.247040 -0.749863 -0.303979
C 3.415118 -0.055707 -0.359908
C 2.102020 -0.499841 -0.958609
C 4.301906 -1.020823 0.206401
C 3.761234 1.329534 -0.359792
C 5.536456 -0.587094 0.749226
C 5.002736 1.729905 0.192120
C 3.945501 -2.498970 0.246239
C 2.821559 2.379746 -0.931428
C 5.889904 0.778900 0.739627
H -4.998455 -1.565837 -0.786195
H -4.925374 -0.001413 -1.664877
H -5.315028 2.176193 -0.093337
H -5.540767 1.794889 1.650017
H -7.304664 -0.206169 -1.636244
H -7.305418 -1.245778 -0.189327
H -7.594763 0.596189 1.212792
H -7.654881 1.691025 -0.193286
H -2.995201 0.961155 -0.391009
H -3.125565 1.037463 1.397005
H -2.693853 -1.529401 -0.272543
H -2.921915 -1.484152 1.502158
H -0.710397 -0.416779 1.673152
H 2.135122 -1.534694 -1.337758
H 1.765279 0.150675 -1.783109
H 6.219912 -1.325729 1.184387
H 5.271045 2.792955 0.193980
H 4.686456 -3.063092 0.837607
H 3.921810 -2.945222 -0.766855
H 2.951210 -2.664626 0.699089
H 3.199179 3.395624 -0.725537
H 1.809229 2.297165 -0.496084
H 2.714025 2.282420 -2.029153
H 6.848145 1.101324 1.162706


