%chk=000065502.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065502

0 1
 O    1.280300      0.7669000      -1.787600    
 N   -3.388100       1.013900      0.6107000    
 N    1.021100      -1.791800      -1.402600    
 C   -3.685600       1.244900     -0.8288000    
 C   -3.630300     -0.4047000      0.9884000    
 C   -5.136500      0.8508000      -1.161900    
 C   -5.080700     -0.8186000      0.6763000    
 C   -5.426300     -0.5910000     -0.7844000    
 C   -2.018000       1.426100      0.9433000    
 C   -1.009300      0.6562000      8.9699998E-02
 C   -3.494800       2.708900      -1.258800    
 C   -3.381300     -0.6850000       2.479700    
 C   0.4315000       1.093600      0.4124000    
 C    1.526700      0.3659000     -0.4263000    
 C    2.964700      0.7986000     -9.6799999E-02
 C    1.389000      -1.157300     -0.2893000    
 C    3.988100      0.2916000     -0.8580000    
 C    3.160100       1.672500      0.9434000    
 C    1.649000      -1.711900      0.9306000    
 C    5.292800      0.6843000     -0.5595000    
 C    4.464900       2.065200       1.241900    
 C    1.515400      -3.092900       1.021500    
 C    5.531200       1.571000      0.4904000    
 C   0.9015000      -3.132500      -1.276000    
 C    1.134900      -3.824200     -9.8399997E-02
 H   -3.062700      0.6119000      -1.471100    
 H   -2.994100      -1.081300      0.4058000    
 H   -5.327300      0.9818000      -2.234300    
 H   -5.835600       1.512900     -0.6336000    
 H   -5.776700     -0.2505000       1.308100    
 H   -5.231000      -1.878700      0.9151000    
 H   -6.482700     -0.8213000     -0.9614000    
 H   -4.838000      -1.267400      -1.416300    
 H   -1.807700       1.293200       2.009600    
 H   -1.899100       2.505200      0.7927000    
 H   -1.153100      0.8308000     -0.9790000    
 H   -1.085500     -0.4183000      0.2684000    
 H   -4.043100       3.391300     -0.5999000    
 H   -3.863200       2.865300      -2.279100    
 H   -2.440800       3.002700      -1.260600    
 H   -2.316400     -0.6521000       2.729100    
 H   -3.731600      -1.687500       2.751300    
 H   -3.910500      3.4499999E-02   3.114300    
 H   0.5851000      0.9207000       1.485600    
 H   0.4932000       2.176500      0.2365000    
 H    1.527500       1.703200      -1.879300    
 H    3.815700     -0.3946000      -1.681000    
 H    2.372500       2.088000       1.558200    
 H    1.940700      -1.137000       1.801000    
 H    6.123000      0.3006000      -1.145400    
 H    4.651600       2.755900       2.059100    
 H    1.706100      -3.598400       1.963400    
 H    6.547100       1.877000      0.7226000    
 H   0.6020000      -3.656300      -2.177800    
 H    1.024000      -4.901400     -5.0600000E-02


%chk=000065502-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000065502

0 1
O 1.368722 0.562158 -1.824031
N -3.473954 0.936306 0.458377
N 0.847119 -1.981762 -1.114303
C -3.862916 1.261828 -0.955408
C -3.875163 -0.459514 0.837888
C -5.397556 1.130988 -1.113733
C -5.409708 -0.615377 0.700564
C -5.893515 -0.272953 -0.721044
C -2.058391 1.267516 0.784669
C -0.964003 0.462074 0.028314
C -3.423734 2.680903 -1.371655
C -3.450098 -0.818502 2.277141
C 0.445580 0.917986 0.452208
C 1.602212 0.285209 -0.384757
C 2.990371 0.851293 -0.011546
C 1.579490 -1.251540 -0.221961
C 4.077843 0.561612 -0.880535
C 3.234941 1.643440 1.137482
C 2.257034 -1.855750 0.869376
C 5.371768 1.050323 -0.608161
C 4.532433 2.138240 1.410548
C 2.174777 -3.253494 1.044821
C 5.605335 1.843368 0.541238
C 0.787320 -3.333905 -0.939722
C 1.427336 -4.016570 0.118915
H -3.394443 0.527192 -1.663157
H -3.404938 -1.199690 0.136371
H -5.668505 1.356806 -2.163739
H -5.879415 1.893212 -0.469274
H -5.894137 0.059440 1.434448
H -5.687574 -1.654902 0.963940
H -6.997648 -0.328038 -0.781126
H -5.493449 -1.019973 -1.437894
H -1.919532 1.138271 1.874367
H -1.908836 2.346859 0.595606
H -1.066540 0.587687 -1.065343
H -1.085162 -0.618882 0.226016
H -3.759274 3.422088 -0.622535
H -3.888333 2.936268 -2.341448
H -2.330837 2.774051 -1.497091
H -2.358438 -0.942118 2.386929
H -3.920446 -1.775280 2.568615
H -3.790196 -0.037983 2.982979
H 0.600245 0.682801 1.525016
H 0.519964 2.022503 0.352304
H 1.528922 1.533544 -1.954764
H 3.889523 -0.046584 -1.771917
H 2.420096 1.885450 1.827206
H 2.846438 -1.240815 1.556534
H 6.197748 0.815851 -1.289246
H 4.702095 2.752745 2.302074
H 2.690831 -3.737558 1.881045
H 6.609758 2.226129 0.754244
H 0.196659 -3.881625 -1.684020
H 1.341881 -5.104127 0.210476


