%chk=000077846.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077846

0 1
 O   -5.856600     -0.4363000     -7.9999998E-04
 N   0.5408000     -1.5000000E-03 -7.9999998E-04
 C  -0.8633000      0.1309000     -3.0000001E-04
 C    1.413700       1.173800     -3.9999999E-04
 C    1.178300      -1.319400     -1.9999999E-04
 C   -1.444300       1.399100      3.9999999E-04
 C   -1.671100      -1.006200     -7.9999998E-04
 C    1.798500       1.690600      -1.208200    
 C    1.458200      -1.899100       1.208100    
 C    1.797200       1.690500       1.207800    
 C    1.459700      -1.898900      -1.208100    
 C   -2.832900       1.530100      8.9999998E-04
 C   -3.059900     -0.8752000     -5.0000002E-04
 C   -3.640700      0.3931000      3.9999999E-04
 C    2.630800       2.810000      -1.207700    
 C    2.066200      -3.154400       1.208300    
 C    2.629400       2.810000       1.208200    
 C    2.067600      -3.154400      -1.207600    
 C    3.046100       3.369700      3.9999999E-04
 C    2.370900      -3.782100      6.9999998E-04
 C   -5.088600      0.5297000       0.000000    
 H  -0.8627000       2.315600      6.0000003E-04
 H   -1.271100      -2.015400     -1.6000000E-03
 H    1.475100       1.260300      -2.150400    
 H    1.219900      -1.415800       2.150000    
 H    1.472800       1.260100       2.149800    
 H    1.222700      -1.415400      -2.150300    
 H   -3.271200       2.524900      1.5000000E-03
 H   -3.670200      -1.774600     -1.0000000E-03
 H    2.954500       3.246300      -2.148100    
 H    2.301500      -3.643600       2.149100    
 H    2.952100       3.246400       2.148900    
 H    2.304100      -3.643600      -2.148000    
 H    3.693700       4.241500      7.9999998E-04
 H    2.843800      -4.759700      8.9999998E-04
 H   -5.488800       1.557900      6.0000003E-04


%chk=000077846-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000077846

0 1
O -6.029160 -0.410922 -0.000805
N 0.519127 -0.000112 -0.000363
C -0.879639 0.129419 -0.000073
C 1.388541 1.164460 -0.000158
C 1.161560 -1.304219 -0.000103
C -1.494098 1.422387 0.000198
C -1.721809 -1.031774 -0.000205
C 1.818399 1.728596 -1.225479
C 1.477600 -1.938505 1.225512
C 1.818062 1.728418 1.225369
C 1.480413 -1.937584 -1.225457
C -2.891520 1.537428 0.000365
C -3.114416 -0.896875 -0.000046
C -3.729314 0.388074 0.000271
C 2.685833 2.844180 -1.223959
C 2.120240 -3.197056 1.224405
C 2.685477 2.844009 1.224248
C 2.123067 -3.196127 -1.223827
C 3.122704 3.402137 0.000244
C 2.445406 -3.826989 0.000421
C -5.193283 0.539971 0.000482
H -0.869894 2.320321 0.000262
H -1.269121 -2.027432 -0.000476
H 1.469033 1.293440 -2.168048
H 1.214168 -1.446305 2.167917
H 1.468484 1.293092 2.167783
H 1.219133 -1.444676 -2.168089
H -3.349318 2.535429 0.000574
H -3.762734 -1.780506 -0.000152
H 3.018746 3.275923 -2.174198
H 2.364301 -3.684256 2.174756
H 3.018131 3.275616 2.174640
H 2.369309 -3.682615 -2.173980
H 3.796501 4.265981 0.000404
H 2.943556 -4.802706 0.000626
H -5.547284 1.604681 -0.000456


