%chk=000014624.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014624

0 1
 O   0.5991000     -0.6340000      1.7800000E-02
 N   -4.870000     -0.2532000     -1.8999999E-02
 C   -2.833300      0.6569000      9.2000002E-03
 C   -3.526800     -0.5550000     -1.2600000E-02
 C  -0.7633000     -0.6015000      8.1000002E-03
 C   -1.424500      0.6320000      1.9600000E-02
 C   -2.879300      -1.795600     -2.4400000E-02
 C   -3.806500       1.694900      1.5900001E-02
 C   -1.481400      -1.795500     -1.3700000E-02
 C    1.276700      0.6206000      3.9999999E-02
 C   -5.048900       1.104100     -2.2000000E-03
 C    2.757300      0.3782000      1.5900001E-02
 C    3.451600      0.2379000       1.212300    
 C    3.421700      0.2964000      -1.202700    
 C    4.828100      1.3000000E-02   1.189900    
 C    4.798100      7.1300000E-02  -1.225200    
 C    5.501200     -7.0299998E-02 -2.8899999E-02
 H  -0.9248000       1.592600      3.9099999E-02
 H   -3.437600      -2.725600     -4.1299999E-02
 H   -3.619400       2.760000      3.1900000E-02
 H   -5.615400     -0.9355000     -3.4100000E-02
 H  -0.9530000      -2.746000     -2.2500001E-02
 H    1.028300       1.181700      0.9508000    
 H    1.013900       1.224200     -0.8390000    
 H   -6.043100       1.528300     -4.3000001E-03
 H    2.937300      0.2985000       2.167400    
 H    2.884100      0.4027000      -2.141000    
 H    5.375600     -9.8099999E-02   2.121300    
 H    5.322300      5.5999998E-03  -2.174100    
 H    6.572900     -0.2459000     -4.6399999E-02


%chk=000014624-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000014624

0 1
O 0.605579 -0.528278 0.004547
N -4.982900 -0.356198 -0.014270
C -2.950994 0.696824 0.016249
C -3.598802 -0.588132 -0.012813
C -0.802479 -0.440564 0.001525
C -1.529511 0.767293 0.023837
C -2.862769 -1.795359 -0.034136
C -3.996696 1.698866 0.032163
C -1.461372 -1.709648 -0.026710
C 1.352946 0.742123 0.025187
C -5.218745 1.025124 0.012805
C 2.830522 0.418796 0.010189
C 3.540317 0.238658 1.223597
C 3.523472 0.282751 -1.218643
C 4.918250 -0.074217 1.210817
C 4.901298 -0.030024 -1.236454
C 5.602174 -0.208016 -0.020409
H -1.029576 1.740151 0.047271
H -3.355224 -2.773968 -0.056155
H -3.867976 2.779701 0.054670
H -5.700108 -1.077372 -0.032193
H -0.839256 -2.609625 -0.042829
H 1.080717 1.313751 0.937980
H 1.071117 1.348623 -0.861785
H -6.232488 1.422364 0.016219
H 3.009348 0.336675 2.178443
H 2.979292 0.415057 -2.161857
H 5.456628 -0.211619 2.155402
H 5.426498 -0.133069 -2.192760
H 6.671638 -0.447969 -0.032086


