%chk=000097487.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097487

0 1
 O   -3.509700     -0.8811000     -1.4000000E-03
 O    5.633000     -0.5598000     -1.9999999E-04
 N   0.6707000       1.765200      5.0000002E-04
 C   -4.389400      0.2650000      9.9999997E-05
 C  -0.1723000      0.6753000      3.9999999E-04
 C   -1.574900      0.5874000      1.9999999E-04
 C   0.6417000     -0.4614000      3.9999999E-04
 C   -2.156500     -0.6825000     -3.0000001E-04
 C    2.003100     -2.0099999E-02  3.0000001E-04
 C   -1.364900      -1.828900     -1.9999999E-04
 C    1.987900       1.373300      1.9999999E-04
 C   3.0500000E-02  -1.733100      1.9999999E-04
 C   -3.718600       1.620300     -6.9999998E-04
 C   -2.393300       1.782100     -6.9999998E-04
 C   -5.266500      0.1354000      -1.251000    
 C   -5.262200      0.1349000       1.253800    
 C    3.249400     -0.6814000      9.9999997E-05
 C   -1.984500      -3.190000     -8.9999998E-04
 C    3.156400       2.143700     -3.9999999E-04
 C    4.426900      7.4600004E-02 -9.9999997E-05
 C    4.378800       1.466600     -7.9999998E-04
 C    5.614700      -1.985700      3.9999999E-04
 H   0.3648000       2.728100      3.9999999E-04
 H   0.6489000      -2.626900      9.9999997E-05
 H   -4.352800       2.503600     -1.0000000E-03
 H   -1.947600       2.768500     -1.2000001E-03
 H   -4.656500      0.1813000      -2.161300    
 H   -5.776900     -0.8347000      -1.271600    
 H   -6.024800      0.9244000      -1.305300    
 H   -6.020300      0.9237000       1.311000    
 H   -5.772500     -0.8353000       1.275700    
 H   -4.649200      0.1804000       2.162100    
 H    3.226600      -1.764400      3.0000001E-04
 H   -2.602500      -3.326400     -0.8947000    
 H   -1.230400      -3.984300      5.0000002E-04
 H   -2.605200      -3.326200      0.8910000    
 H    3.119200       3.228000     -6.9999998E-04
 H    5.301700       2.041700     -1.2000001E-03
 H    5.152200      -2.383600     -0.9092000    
 H    5.152400      -2.382800      0.9106000    
 H    6.656900      -2.321800      3.9999999E-04


%chk=000097487-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097487

0 1
O -3.545943 -0.843771 -0.002379
O 5.772481 -0.532337 0.001006
N 0.685073 1.817666 -0.000440
C -4.517340 0.315308 0.000292
C -0.159522 0.697738 -0.000761
C -1.575041 0.637989 -0.001263
C 0.653844 -0.484741 -0.000538
C -2.154628 -0.660705 -0.001442
C 2.044587 -0.047020 -0.000081
C -1.382149 -1.863202 -0.001321
C 2.028939 1.387506 -0.000047
C 0.024900 -1.752232 -0.000838
C -3.815024 1.663757 -0.001728
C -2.460624 1.800869 -0.002140
C -5.371671 0.131727 -1.274851
C -5.365016 0.132241 1.280035
C 3.281137 -0.739631 0.000271
C -2.081317 -3.206839 -0.001764
C 3.220618 2.141353 0.000341
C 4.473096 0.019639 0.000654
C 4.443602 1.445010 0.000690
C 5.878181 -1.989456 0.001053
H 0.384413 2.788464 -0.000465
H 0.627135 -2.668409 -0.000686
H -4.475380 2.538973 -0.002542
H -2.022857 2.806962 -0.003354
H -4.742955 0.228481 -2.175726
H -5.837218 -0.869279 -1.272328
H -6.171438 0.893943 -1.319151
H -6.164316 0.894706 1.328474
H -5.830871 -0.868634 1.280184
H -4.731514 0.229037 2.177553
H 3.300118 -1.833174 0.000229
H -2.734484 -3.319496 -0.886876
H -1.348201 -4.031572 -0.000747
H -2.736495 -3.319015 0.881907
H 3.210599 3.236632 0.000374
H 5.399129 1.977617 0.000994
H 5.411827 -2.430406 -0.902908
H 5.411247 -2.430391 0.904719
H 6.957378 -2.202206 0.001399


