%chk=000003245.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003245

0 1
 O    3.556300       1.594600      0.1613000    
 O   -5.858000      -2.167800      0.6291000    
 N   -1.322900      -1.071900      0.2087000    
 N    1.434800     -0.3188000     -0.2231000    
 C  -0.4444000     -0.7192000       1.330700    
 C  -0.9080000     -0.3641000      -1.008700    
 C    1.019100      -1.025800      0.9945000    
 C   0.5556000     -0.6695000      -1.345300    
 C   -2.718200     -0.7785000      0.5298000    
 C    2.829700     -0.6143000     -0.5444000    
 C   -3.685300      -1.653400     -0.2808000    
 C    3.778300      0.1972000      0.3464000    
 C   -3.429200      -3.148800     -6.2600002E-02
 C    5.227200     -9.7800002E-02  2.6100000E-02
 C   -5.121300      -1.319900      0.1265000    
 C   -5.647100      6.2500000E-02 -7.2200000E-02
 C    5.896900      0.6583000     -0.9361000    
 C    5.893300      -1.126400      0.6926000    
 C    4.014600       2.342100       1.277300    
 C    7.232700      0.3858000      -1.231500    
 C    7.229200      -1.398600      0.3972000    
 C   -5.163900      0.8490000      -1.118100    
 C   -6.622300      0.5682000      0.7877000    
 C    3.754400       3.812200       1.026500    
 C    7.898700     -0.6426000     -0.5648000    
 C   -5.655500       2.141000      -1.303900    
 C   -7.114000       1.860100      0.6016000    
 C   -6.630500       2.646500     -0.4442000    
 H  -0.5508000      0.3424000       1.592300    
 H  -0.7188000      -1.304400       2.217100    
 H   -1.037400      0.7211000     -0.8964000    
 H   -1.520400     -0.6774000      -1.861600    
 H    1.148500      -2.111000      0.8818000    
 H    1.621400     -0.7149000       1.854200    
 H   0.8297000     -8.3700001E-02  -2.231300    
 H   0.6618000      -1.730800      -1.608200    
 H   -2.925800      0.2923000      0.4187000    
 H   -2.907200     -0.9969000       1.591100    
 H    3.041900      -1.689900     -0.4838000    
 H    3.024900     -0.3165000      -1.584300    
 H   -3.589700      -1.470200      -1.356100    
 H    3.602900     -5.9099998E-02   1.398800    
 H   -2.442400      -3.442400     -0.4347000    
 H   -4.170300      -3.754700     -0.5963000    
 H   -3.485200      -3.414500      0.9990000    
 H    5.399000       1.455100      -1.481700    
 H    5.381800      -1.723900       1.442500    
 H    3.471800       2.033200       2.178200    
 H    5.086300       2.190800       1.443900    
 H    7.753500      0.9719000      -1.983100    
 H    7.747600      -2.199900      0.9156000    
 H   -4.415800      0.4848000      -1.814800    
 H   -7.007400     -2.8000001E-02   1.610700    
 H    4.278500       4.147400      0.1253000    
 H    2.687200       3.992200      0.8597000    
 H    4.086300       4.418600       1.873800    
 H    8.938400     -0.8553000     -0.7956000    
 H   -5.281600       2.752600      -2.119800    
 H   -7.872500       2.254500       1.271500    
 H   -7.013600       3.652400     -0.5893000    


%chk=000003245-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000003245

0 1
O 3.660730 1.753568 -0.157856
O -5.746605 -2.188758 0.861086
N -1.270700 -1.160644 0.252822
N 1.490557 -0.405091 -0.181378
C -0.285620 -1.182422 1.363668
C -0.903444 -0.123204 -0.742358
C 1.128904 -1.435728 0.817452
C 0.511653 -0.375304 -1.290188
C -2.665196 -1.045844 0.732047
C 2.901616 -0.481787 -0.611170
C -3.709271 -1.556019 -0.320125
C 3.839238 0.364517 0.287626
C -3.494832 -3.049620 -0.630451
C 5.296389 -0.088306 0.179401
C -5.118315 -1.283428 0.234438
C -5.737438 0.081781 0.066171
C 6.109870 0.357755 -0.892581
C 5.839272 -0.998151 1.119728
C 4.160449 2.746869 0.807472
C 7.438705 -0.102627 -1.023704
C 7.168069 -1.462764 0.990056
C -5.074578 1.162874 -0.576935
C -7.045391 0.289920 0.585342
C 3.852046 4.131249 0.237732
C 7.972027 -1.016881 -0.084492
C -5.706498 2.419423 -0.698374
C -7.677277 1.542056 0.461338
C -7.008696 2.612341 -0.181926
H -0.281172 -0.216798 1.929797
H -0.561510 -1.992700 2.063781
H -0.937465 0.900782 -0.289598
H -1.620862 -0.153639 -1.583243
H 1.166678 -2.465001 0.376373
H 1.852080 -1.399800 1.654376
H 0.787659 0.442225 -1.980499
H 0.500397 -1.334952 -1.867383
H -2.910804 0.004404 1.031069
H -2.770605 -1.675120 1.636309
H 3.272079 -1.534286 -0.632301
H 2.997357 -0.082638 -1.638028
H -3.576852 -0.971450 -1.250881
H 3.501451 0.264786 1.344121
H -2.431531 -3.222165 -0.868432
H -4.116336 -3.373909 -1.484342
H -3.776718 -3.666198 0.240314
H 5.693716 1.078786 -1.605542
H 5.222422 -1.342424 1.960377
H 3.651312 2.596517 1.785284
H 5.252453 2.612408 0.962685
H 8.059596 0.251329 -1.854839
H 7.576866 -2.164249 1.726392
H -4.066711 1.034075 -0.984767
H -7.539433 -0.552772 1.080455
H 4.359794 4.273858 -0.732242
H 2.766123 4.249140 0.079679
H 4.195468 4.920243 0.931672
H 9.003552 -1.372845 -0.185375
H -5.186612 3.246151 -1.194742
H -8.686354 1.688802 0.861911
H -7.498900 3.587563 -0.279721


