%chk=000069776.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000069776

0 1
 O    6.661000       1.079100      0.2288000    
 O   -6.653400       1.079000     -0.2699000    
 O    6.647700      -1.116000      0.2206000    
 O   -6.640000      -1.116200     -0.2605000    
 N    6.051700     -1.4400000E-02  0.1422000    
 N   -6.045300     -1.4600000E-02 -0.1737000    
 C   0.4034000      2.4700001E-02 -0.6284000    
 C  -0.4092000      2.5000000E-02  0.6816000    
 C    1.881000      1.3900000E-02 -0.4271000    
 C   -1.901400      1.4100000E-02  0.4555000    
 C    2.579600       1.217100     -0.3280000    
 C   -2.580700       1.217300      0.3480000    
 C    2.564400      -1.198800     -0.3376000    
 C   -2.565600      -1.198600      0.3590000    
 C    3.961600       1.207500     -0.1395000    
 C   -3.959800       1.207600      0.1387000    
 C    3.946400      -1.208300     -0.1489000    
 C   -3.944700      -1.208200      0.1495000    
 C    4.645100     -5.1000002E-03 -4.9800001E-02
 C   -4.641700     -5.1000002E-03  3.9400000E-02
 H   0.1145000     -0.8414000      -1.239500    
 H   0.1245000      0.8983000      -1.233500    
 H  -0.1292000     -0.8429000       1.294100    
 H  -0.1392000      0.9007000       1.287300    
 H    2.057800       2.168300     -0.3940000    
 H   -2.057400       2.166400      0.4218000    
 H    2.030700      -2.142800     -0.4111000    
 H   -2.030300      -2.140200      0.4414000    
 H    4.472800       2.164100     -6.6200003E-02
 H   -4.469800       2.164100      5.7399999E-02
 H    4.445500      -2.171700     -8.3099999E-02
 H   -4.442600      -2.171700      7.6800004E-02


%chk=000069776-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000069776

0 1
O 6.733430 1.145595 0.285014
O -6.734881 1.145441 -0.276019
O 6.733665 -1.135370 0.285308
O -6.735102 -1.135524 -0.275267
N 6.134432 0.005042 0.191334
N -6.135887 0.004928 -0.181927
C 0.381725 0.004302 -0.679205
C -0.383172 0.004642 0.688719
C 1.887259 0.004480 -0.482692
C -1.888756 0.004719 0.492114
C 2.602862 1.226229 -0.368981
C -2.604301 1.226399 0.377846
C 2.603165 -1.217091 -0.368789
C -2.604585 -1.216902 0.378815
C 3.993124 1.238960 -0.147848
C -3.994527 1.239030 0.156686
C 3.993428 -1.229455 -0.147627
C -3.994811 -1.229399 0.157636
C 4.670132 0.004846 -0.038794
C -4.671505 0.004853 0.048212
H 0.068461 -0.884893 -1.257159
H 0.068267 0.893095 -1.257681
H -0.069862 -0.884264 1.267112
H -0.069671 0.893720 1.266747
H 2.065196 2.176733 -0.463605
H -2.066600 2.176948 0.472031
H 2.065718 -2.167733 -0.463250
H -2.067088 -2.167491 0.473742
H 4.558337 2.170685 -0.063022
H -4.559713 2.170725 0.071411
H 4.558873 -2.161023 -0.062630
H -4.560215 -2.161026 0.073073


