%chk=000176058.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176058

0 1
 O   0.9827000      -2.460400      0.2069000    
 O   -1.363600      0.3240000       2.124800    
 O   -5.314300      0.6037000     -0.2247000    
 N   6.8400003E-02 -0.3044000     -0.1117000    
 N   -3.312200      0.4730000      0.9100000    
 C   -1.345100     -0.5739000     -0.1198000    
 C   -1.978900     -0.1206000      -1.424700    
 C   0.5848000       1.048800     -0.2786000    
 C   -3.471200     -0.3941000      -1.382500    
 C    2.057200      0.8290000     -0.2037000    
 C    1.069200      -1.256600      4.7899999E-02
 C   -1.969500      0.1329000       1.070500    
 C    2.339100     -0.5244000     -1.2100000E-02
 C   -4.125100      0.2870000     -0.2041000    
 C    3.084100       1.749000     -0.2972000    
 C    3.627600      -1.010700      9.3000002E-02
 C    4.398900       1.282800     -0.1937000    
 C    4.667800     -8.4899999E-02 -1.9999999E-04
 H   -1.503000      -1.650300      2.1500001E-02
 H   -1.525200     -0.6434000      -2.274800    
 H   -1.829500      0.9538000      -1.588900    
 H   0.2357000       1.696600      0.5290000    
 H   0.3063000       1.441800      -1.259500    
 H   -3.669400      -1.469200      -1.307400    
 H   -3.939100     -2.4400000E-02  -2.301300    
 H   -3.753000      0.9203000       1.709200    
 H    2.882900       2.804200     -0.4463000    
 H    3.832300      -2.064500      0.2418000    
 H    5.225300       1.985200     -0.2635000    
 H    5.698200     -0.4219000      7.7000000E-02


%chk=000176058-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000176058

0 1
O 0.732850 -2.384520 -0.032037
O -1.511118 0.888648 2.028293
O -5.516105 0.240867 -0.203421
N 0.080216 -0.109042 -0.109657
N -3.469876 0.504437 0.852037
C -1.344967 -0.398053 -0.085658
C -2.045443 -0.200908 -1.457137
C 0.690750 1.237445 -0.124033
C -3.525183 -0.626197 -1.366151
C 2.177092 0.916281 -0.128137
C 1.024695 -1.153520 -0.069341
C -2.073257 0.382693 1.022718
C 2.357386 -0.487236 -0.090005
C -4.272484 0.059764 -0.228873
C 3.289145 1.776851 -0.153239
C 3.639082 -1.070373 -0.074224
C 4.583533 1.199714 -0.139406
C 4.758920 -0.208411 -0.099896
H -1.406885 -1.479719 0.174620
H -1.520737 -0.814300 -2.209093
H -1.970176 0.856488 -1.775810
H 0.388157 1.805817 0.776176
H 0.386963 1.812867 -1.021764
H -3.597469 -1.720155 -1.200174
H -4.075939 -0.412447 -2.297192
H -3.970417 0.979924 1.614417
H 3.167748 2.865514 -0.179069
H 3.748503 -2.159193 -0.041503
H 5.464805 1.850664 -0.157539
H 5.771612 -0.625499 -0.088001


