%chk=000127771.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127771

0 1
 O   0.1951000       3.172000      -1.757100    
 O   -1.234100       1.598100      3.5100002E-02
 O    5.180700     -0.3162000      0.8880000    
 O    3.156900     -0.1779000       1.911400    
 O   -1.998900       1.674200       2.204800    
 N    1.926500      0.1388000     -0.5273000    
 C    1.251800       1.039700      -1.451800    
 C   0.8834000       2.370800     -0.7924000    
 C    1.795600      -1.250700     -0.9713000    
 C    3.340300      0.4970000     -0.3953000    
 C  -1.1900000E-02   2.210500      0.4344000    
 C   0.4320000      -1.811200     -0.6655000    
 C   0.1981000      -2.451400      0.5515000    
 C  -0.5975000      -1.689800      -1.598800    
 C    3.852300     -3.8800001E-02  0.9132000    
 C   -1.065100      -2.970500      0.8351000    
 C   -1.860800      -2.208800      -1.315100    
 C   -2.094500      -2.849200     -9.7999997E-02
 C   -2.147300       1.385200       1.025900    
 C   -3.365800      0.7414000      0.4607000    
 C   -3.775100       1.009500     -0.9552000    
 C   -4.062000     -7.2800003E-02   1.267500    
 H   0.3203000      0.6341000      -1.848300    
 H    1.862000       1.224300      -2.347500    
 H    1.781900       2.927600     -0.5091000    
 H    2.527300      -1.896500     -0.4663000    
 H    2.019800      -1.355800      -2.042300    
 H    3.499000       1.579600     -0.3508000    
 H    3.935300      0.1045000      -1.228900    
 H   0.4769000       1.612500       1.211300    
 H  -0.2436000       3.202700      0.8404000    
 H   0.9906000      -2.550000       1.288700    
 H  -0.4302000      -1.230500      -2.568900    
 H  -0.6449000       2.728600      -1.966700    
 H   -1.247600      -3.468100       1.783100    
 H   -2.660400      -2.122300      -2.045000    
 H   -3.077700      -3.254600      0.1220000    
 H    5.501700     -0.6474000       1.753700    
 H   -3.914000       2.084600      -1.110100    
 H   -3.013400      0.6560000      -1.656600    
 H   -4.717300      0.5133000      -1.211000    
 H   -4.958600     -0.5739000      0.9170000    
 H   -3.759600     -0.2699000       2.290900    


%chk=000127771-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127771

0 1
O 0.234886 3.422675 -1.135953
O -1.352452 1.549226 0.191558
O 5.519834 0.199227 0.597094
O 3.675694 -0.925280 1.454807
O -2.158724 1.105723 2.329772
N 2.047819 0.122729 -0.693858
C 1.199452 1.151233 -1.337582
C 0.854465 2.322279 -0.380484
C 1.824738 -1.264722 -1.183642
C 3.462844 0.484379 -0.598239
C -0.030118 1.893215 0.792817
C 0.462392 -1.816043 -0.783436
C 0.100856 -1.870317 0.587515
C -0.445455 -2.301839 -1.754652
C 4.165067 -0.171071 0.590731
C -1.151659 -2.390547 0.976608
C -1.699519 -2.832403 -1.366892
C -2.056250 -2.874625 -0.000036
C -2.354191 1.151724 1.091795
C -3.629110 0.817086 0.373917
C -3.633400 0.784043 -1.139822
C -4.720283 0.547980 1.142603
H 0.255160 0.668900 -1.647667
H 1.665416 1.589513 -2.250683
H 1.781030 2.761469 0.032660
H 2.610424 -1.896436 -0.729162
H 1.948273 -1.332521 -2.292591
H 3.568327 1.576724 -0.466192
H 4.061164 0.238008 -1.510693
H 0.382461 1.005960 1.300933
H -0.177324 2.712070 1.517643
H 0.813847 -1.501005 1.333881
H -0.171067 -2.268665 -2.816984
H -0.712814 3.170442 -1.291498
H -1.423920 -2.419120 2.037466
H -2.392619 -3.210362 -2.127419
H -3.028476 -3.278859 0.303824
H 5.973176 -0.220364 1.377790
H -3.341291 1.762183 -1.563198
H -2.907385 0.039323 -1.513926
H -4.634978 0.522665 -1.521508
H -5.686405 0.295280 0.692588
H -4.652685 0.578822 2.235517


