%chk=000140036.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000140036

0 1
 O   -1.959600       1.192000     -0.7916000    
 O   0.2500000       3.644600      0.7533000    
 N    1.361100       1.002500      0.3777000    
 C  -0.2341000       2.781300     -0.2794000    
 C   0.9115000       1.861700     -0.7091000    
 C   -1.451300       2.024000      0.2467000    
 C    2.348400      5.1600002E-02  0.2311000    
 C   -2.565500      2.6500000E-02 -0.4049000    
 C    2.992700     -0.1460000      -1.008700    
 C    2.748600     -0.7572000       1.316000    
 C    3.991200      -1.108600      -1.157100    
 C    3.747200      -1.719700       1.167500    
 C   -3.216400     -3.7799999E-02  0.8224000    
 C   -2.523900      -1.082600      -1.243100    
 C    4.368400      -1.895400     -6.9100000E-02
 C   -3.832900      -1.225300       1.216400    
 C   -3.140500      -2.270100     -0.8490000    
 C   -3.795000      -2.341400      0.3808000    
 H  -0.5233000       3.405200      -1.132500    
 H    1.752200       2.486200      -1.035700    
 H   0.5804000       1.254300      -1.559600    
 H   -2.225700       2.743200      0.5414000    
 H   -1.168900       1.461900       1.145700    
 H   0.9632000       1.122700       1.301600    
 H   0.4811000       3.098600       1.523300    
 H    2.734300      0.4445000      -1.883800    
 H    2.275000     -0.6347000       2.287900    
 H    4.475700      -1.245400      -2.119500    
 H    4.041100      -2.332600       2.014600    
 H   -3.297900      0.8162000       1.487900    
 H   -2.014300      -1.031500      -2.201000    
 H    5.146000      -2.644900     -0.1845000    
 H   -4.349100      -1.279300       2.170500    
 H   -3.111100      -3.139200      -1.499600    
 H   -4.276500      -3.265600      0.6869000    


%chk=000140036-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000140036

0 1
O -1.948504 0.420827 -0.752017
O 0.911776 2.606108 0.155341
N 1.507031 -0.277509 -0.466711
C 0.065697 1.772829 -0.712996
C 0.874165 0.652481 -1.410868
C -1.097361 1.230164 0.136122
C 2.858820 -0.242550 -0.071669
C -3.110598 -0.153398 -0.203788
C 3.696422 0.888840 -0.304578
C 3.413405 -1.373703 0.599245
C 5.044228 0.869418 0.116067
C 4.756356 -1.371552 1.022104
C -3.502706 -0.018293 1.151053
C -3.899038 -0.908841 -1.107238
C 5.588889 -0.251288 0.782650
C -4.690438 -0.648823 1.591400
C -5.078450 -1.530362 -0.652086
C -5.482374 -1.405367 0.700520
H -0.324754 2.465452 -1.478688
H 1.643910 1.116082 -2.054117
H 0.181488 0.092578 -2.064737
H -1.669467 2.076064 0.562602
H -0.703470 0.602125 0.963038
H 1.012622 -1.152918 -0.293760
H 1.443808 2.004843 0.741187
H 3.303135 1.780697 -0.802170
H 2.783833 -2.254608 0.781713
H 5.670366 1.749084 -0.073990
H 5.157389 -2.252967 1.535910
H -2.905377 0.564290 1.858596
H -3.573868 -0.991745 -2.149118
H 6.633701 -0.253287 1.109281
H -4.993304 -0.543223 2.639304
H -5.685096 -2.112641 -1.354606
H -6.400133 -1.889105 1.050504


