%chk=000066700.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066700

0 1
 O   0.5367000      -2.784300     -0.6157000    
 O    3.992400       1.381200      0.4368000    
 O  -0.5976000       2.056200      0.3748000    
 N  -0.4965000     -0.2327000     -6.5200001E-02
 C   0.9001000     -0.4748000     -7.8900002E-02
 C    1.378400      -1.744400     -0.3550000    
 C    1.758300      0.5791000      0.1875000    
 C    3.135200      0.3564000      0.1773000    
 C    2.755500      -1.966900     -0.3653000    
 C    3.633800     -0.9165000     -9.8999999E-02
 C   -1.164100      0.9792000      0.1532000    
 C   -2.613400      0.9049000      6.1200000E-02
 C   0.6050000      -3.907600      0.2598000    
 C    3.565600       2.693000      7.2200000E-02
 C   -3.347700       2.033700     -0.3028000    
 C   -3.269400     -0.2950000      0.3366000    
 C  -0.7616000      -4.553800      0.3404000    
 C   -4.738000       1.962600     -0.3913000    
 C   -4.659700     -0.3659000      0.2479000    
 C    4.780900       3.532800     -0.2585000    
 C   -5.393900      0.7628000     -0.1161000    
 H    1.418300       1.562200      0.4612000    
 H    3.159500      -2.951000     -0.5870000    
 H   -1.042000      -1.055500     -0.3059000    
 H    4.705500      -1.095400     -0.1103000    
 H    1.332700      -4.623700     -0.1372000    
 H   0.9195000      -3.604900       1.266400    
 H    2.923500       2.682000     -0.8177000    
 H    3.025100       3.143300      0.9121000    
 H   -2.855600       2.976900     -0.5257000    
 H   -2.749400      -1.189500      0.6661000    
 H  -0.7431000      -5.428300      0.9967000    
 H   -1.502000      -3.842000      0.7204000    
 H   -1.100600      -4.864800     -0.6533000    
 H   -5.310000       2.841200     -0.6752000    
 H   -5.171900      -1.297100      0.4719000    
 H    4.490700       4.551000     -0.5328000    
 H    5.462400       3.578600      0.5975000    
 H    5.342000       3.089700      -1.087900    
 H   -6.476400      0.7080000     -0.1830000    


%chk=000066700-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000066700

0 1
O 0.258618 -2.641532 0.107625
O 4.199618 1.383086 -0.033437
O -0.705622 2.186969 -0.210266
N -0.545843 -0.145845 -0.025182
C 0.858278 -0.331561 0.000562
C 1.302933 -1.685738 0.073546
C 1.802537 0.721518 -0.038878
C 3.184396 0.412058 -0.001728
C 2.680635 -1.978104 0.106919
C 3.624411 -0.929810 0.069822
C -1.259216 1.045368 -0.095397
C -2.761047 0.904529 -0.043342
C 0.633271 -4.065694 0.160710
C 3.787757 2.799785 -0.108356
C -3.528623 2.006089 -0.501941
C -3.431769 -0.241415 0.462536
C -0.662199 -4.872786 0.175109
C -4.937233 1.957380 -0.478925
C -4.842823 -0.287798 0.489037
C 5.068063 3.630416 -0.122935
C -5.599873 0.807803 0.013192
H 1.424614 1.742368 -0.102411
H 3.034242 -3.011501 0.162131
H -1.066064 -1.028297 -0.016431
H 4.698217 -1.134919 0.094630
H 1.252149 -4.311739 -0.726260
H 1.233792 -4.250566 1.074749
H 3.189515 2.962374 -1.027978
H 3.155145 3.047112 0.768440
H -2.992361 2.889243 -0.863948
H -2.872000 -1.090073 0.874603
H -0.432862 -5.953169 0.210246
H -1.272307 -4.619050 1.059149
H -1.257569 -4.673206 -0.732340
H -5.518658 2.812309 -0.841043
H -5.350492 -1.172172 0.889534
H 4.820670 4.706157 -0.178417
H 5.657967 3.452934 0.792590
H 5.692597 3.368848 -0.994310
H -6.694665 0.769328 0.034593


