%chk=000006151.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006151

0 1
 O  -0.7232000       1.632100     -0.3711000    
 O    2.034400     -0.3673000      0.4293000    
 O  -0.8172000       3.654800      0.7241000    
 O    3.290100      -1.167200      -1.326600    
 N   -1.004500       3.527200      -1.564000    
 N    4.268300     -6.3000001E-02  0.4371000    
 C  -0.4276000     -0.5727000      0.6564000    
 C   -1.694300      -1.152500     -0.1054000    
 C  -0.5525000      0.9618000      0.8705000    
 C   0.8506000     -0.8655000     -0.1856000    
 C   -1.562600      -2.657800     -0.4602000    
 C  -0.2553000      -1.211900       2.051400    
 C   -3.015800     -0.9114000      0.6475000    
 C   -2.746400      -3.215300      -1.244100    
 C  -0.8452000       2.994200     -0.3088000    
 C    3.201000     -0.5856000     -0.2505000    
 H   -1.773700     -0.6122000      -1.059300    
 H   -1.392300       1.198400       1.533400    
 H   0.3541000       1.347100       1.354900    
 H   0.9907000      -1.945500     -0.2935000    
 H   0.7506000     -0.4262000      -1.185900    
 H  -0.6815000      -2.819600      -1.087600    
 H   -1.432500      -3.258700      0.4460000    
 H   0.6068000     -0.7889000       2.580000    
 H  -9.2299998E-02  -2.292000       1.984600    
 H   -1.130700      -1.040600       2.685800    
 H   -3.087300      -1.532600       1.545700    
 H   -3.877900      -1.141700      1.3100000E-02
 H   -3.137100      0.1339000      0.9413000    
 H   -2.969400      -2.595000      -2.117700    
 H   -3.644500      -3.287600     -0.6238000    
 H   -2.516100      -4.225900      -1.597700    
 H   -1.021300       2.938100      -2.389700    
 H   -1.110200       4.526300      -1.704400    
 H    4.143500      0.4103000       1.325700    
 H    5.214400     -0.1341000      7.7900000E-02


%chk=000006151-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000006151

0 1
O -0.740475 1.584900 -0.193728
O 1.734697 -0.082453 0.424791
O 1.128328 2.902373 0.446701
O 3.350470 -0.943266 -1.067724
N 0.054419 3.155056 -1.617933
N 3.588641 1.135901 0.029240
C -0.580585 -0.715091 0.785153
C -1.861362 -1.239361 0.021350
C -0.695151 0.807370 1.074307
C 0.672628 -0.962450 -0.097972
C -1.673744 -2.672078 -0.561596
C -0.380077 -1.406088 2.162439
C -3.140790 -1.174221 0.893296
C -2.859685 -3.157717 -1.426591
C 0.234770 2.577533 -0.380026
C 2.951904 -0.040900 -0.288950
H -2.002399 -0.550177 -0.839486
H -1.634444 1.041176 1.602750
H 0.166905 1.159340 1.663081
H 1.010609 -2.012019 -0.051927
H 0.479062 -0.694942 -1.154504
H -0.763066 -2.703176 -1.189172
H -1.510420 -3.391969 0.266409
H 0.608286 -1.141780 2.578774
H -0.425753 -2.505302 2.064469
H -1.152328 -1.101041 2.891775
H -3.120490 -1.937356 1.693510
H -4.038704 -1.359059 0.278741
H -3.276531 -0.186293 1.367803
H -3.091813 -2.427239 -2.225225
H -3.776125 -3.308499 -0.829260
H -2.618783 -4.121065 -1.912532
H -0.694104 2.839686 -2.230083
H 0.678565 3.904097 -1.902884
H 3.052661 1.872709 0.497625
H 4.517981 1.306800 -0.343823


