%chk=000032323.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032323

0 1
 O  -0.3791000      0.5323000       1.809600    
 N    4.185700       1.150800     -4.1000001E-02
 C  -0.8036000       1.341900     -0.1197000    
 C   -1.812300       1.117000      -1.245500    
 C   -1.396800       1.439600       1.302700    
 C   -3.626300      0.8611000      0.2396000    
 C   1.9800000E-02  0.1840000      0.4594000    
 C   -2.868100      9.2100002E-02 -0.8424000    
 C   -2.798100      0.8686000       1.535500    
 C   -2.656300       2.389000      -1.411300    
 C   -3.776900       2.265300     -0.3675000    
 C    1.468400      0.4030000      0.2391000    
 C  -0.2277000      -1.290300      0.1147000    
 C    2.427300      0.1498000       1.368100    
 C    1.899100      0.7960000     -0.9698000    
 C   5.1800001E-02  -1.780100      -1.170400    
 C  -0.7377000      -2.173600       1.078800    
 C    3.886800      6.1700001E-02  0.8967000    
 C    3.355700       1.041800      -1.253300    
 C  -0.1735000      -3.120400      -1.484200    
 C  -0.9628000      -3.513900      0.7651000    
 C  -0.6808000      -3.987300     -0.5165000    
 C    5.605300       1.171600     -0.3876000    
 H  -0.2154000       2.246200     -0.3406000    
 H   -1.305600      0.8532000      -2.178400    
 H   -1.283500       2.436900       1.745100    
 H   -4.606100      0.4146000      0.4401000    
 H   -2.533100     -0.8772000     -0.4939000    
 H   -3.535500     -0.1008000      -1.693100    
 H   -3.312200       1.460900       2.301800    
 H   -2.744800     -0.1540000       1.925700    
 H   -3.099600       2.414700      -2.414200    
 H   -2.082300       3.311900      -1.280100    
 H   -3.717400       3.055400      0.3884000    
 H   -4.748600       2.363100     -0.8654000    
 H    2.330700      0.9640000       2.097500    
 H    2.172700     -0.7825000       1.885500    
 H    1.223100      0.9612000      -1.802800    
 H   0.4116000      -1.137000      -1.965700    
 H  -0.9588000      -1.839800       2.088400    
 H    4.535200      0.1269000       1.779000    
 H    4.071300     -0.9157000      0.4302000    
 H    3.712500      0.2339000      -1.905600    
 H    3.437900       1.979600      -1.815900    
 H   3.7700001E-02  -3.487500      -2.484300    
 H   -1.356300      -4.189600       1.518700    
 H  -0.8578000      -5.030500     -0.7611000    
 H    5.927000      0.2432000     -0.8731000    
 H    6.217200       1.321300      0.5088000    
 H    5.824400       2.007600      -1.061100    


%chk=000032323-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000032323

0 1
O -0.496284 0.322424 1.584641
N 4.264858 1.128558 0.268654
C -0.963630 1.124801 -0.407164
C -2.255403 0.646443 -1.108919
C -1.162980 1.594947 1.073442
C -3.708303 1.329134 0.675611
C 0.022695 0.035568 0.177623
C -3.264785 0.052083 -0.086600
C -2.579388 1.765285 1.650958
C -3.052962 1.860886 -1.672048
C -3.929165 2.367853 -0.473681
C 1.508286 0.397897 0.112006
C -0.179822 -1.432658 -0.192883
C 2.367678 -0.126715 1.252032
C 2.068676 1.096328 -0.910200
C 0.151028 -1.889470 -1.494565
C -0.666077 -2.360582 0.759546
C 3.855319 -0.168155 0.856514
C 3.545658 1.421409 -0.987892
C -0.022494 -3.246467 -1.843728
C -0.824228 -3.722538 0.415262
C -0.509034 -4.170008 -0.888115
C 5.722432 1.268083 0.115704
H -0.453441 1.869766 -1.040964
H -1.993231 -0.072402 -1.906961
H -0.509546 2.449560 1.332663
H -4.637723 1.173061 1.253822
H -2.823362 -0.711673 0.573033
H -4.119663 -0.402582 -0.622998
H -2.739449 2.816328 1.959957
H -2.617950 1.150798 2.571931
H -3.699193 1.526348 -2.505105
H -2.389994 2.649665 -2.073830
H -3.644060 3.386539 -0.151627
H -4.996305 2.407569 -0.759562
H 2.230499 0.521152 2.137299
H 2.025946 -1.138192 1.546083
H 1.462383 1.452527 -1.753676
H 0.558285 -1.185173 -2.229859
H -0.916439 -1.997702 1.761581
H 4.479829 -0.354520 1.750060
H 4.029135 -1.017705 0.144619
H 3.985957 0.858679 -1.859320
H 3.676690 2.497827 -1.223612
H 0.228509 -3.585603 -2.855428
H -1.195363 -4.432725 1.163233
H -0.636976 -5.224858 -1.156520
H 6.169325 0.529095 -0.599135
H 6.215124 1.136992 1.095688
H 5.963138 2.282127 -0.253571


