%chk=000165829.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000165829

1 1
 O  -0.1873000     -0.8807000      0.5207000    
 N   -4.283400     -0.3976000      0.4281000    
 C   -3.502900      0.7461000     -0.2528000    
 C   -3.768700      -1.597600     -0.3939000    
 C   -3.685200      0.4390000      -1.748400    
 C   -3.857600      -1.082700      -1.840100    
 C   -2.016000      0.6584000      0.1354000    
 C   -2.305300      -1.890700     -1.8100001E-02
 C   -1.374000     -0.6874000     -0.2314000    
 C   -4.066400     -0.5127000       1.935800    
 C   -5.804700     -0.2146000      0.2578000    
 C   0.9470000     -0.3101000     -0.1435000    
 C    1.068500       1.164700      0.2070000    
 C    2.234600      -1.107100      5.6100000E-02
 C    1.842600       2.002100     -0.6200000    
 C    3.473900     -0.7151000     -0.5065000    
 C    2.586700       1.416100      -1.789900    
 C    3.744900      0.5355000      -1.325100    
 C   0.4413000       1.726600       1.331200    
 C    2.190700      -2.320200      0.7803000    
 C    1.959100       3.369100     -0.3263000    
 C    4.611600      -1.526500     -0.2852000    
 C   0.5635000       3.088300       1.615500    
 C    3.327000      -3.105900      0.9789000    
 C    1.318400       3.909600      0.7855000    
 C    4.541800      -2.706500      0.4488000    
 H   -3.943500       1.702500      4.7699999E-02
 H   -4.414800      -2.460700     -0.2027000    
 H   -2.844200      0.7919000      -2.355100    
 H   -4.579000      0.9399000      -2.138400    
 H   -4.835400      -1.321400      -2.274200    
 H   -3.109000      -1.540300      -2.495700    
 H   -1.503700       1.470000     -0.3918000    
 H   -1.940400      0.8642000       1.203600    
 H   -2.233000      -2.257200       1.012500    
 H   -1.934600      -2.728000     -0.6247000    
 H   -1.156600     -0.6789000      -1.307600    
 H   -3.014400     -0.6616000       2.177000    
 H   -4.643800      -1.369500       2.296200    
 H   -4.419200      0.4132000       2.400000    
 H   -6.097900      0.6927000      0.7947000    
 H   -6.300400      -1.092700      0.6828000    
 H   -6.066400     -0.1190000     -0.7967000    
 H   0.7679000     -0.3997000      -1.221700    
 H    1.905000      0.8718000      -2.452700    
 H    2.995200       2.227000      -2.407200    
 H    4.439400       1.157600     -0.7428000    
 H    4.284200      0.2232000      -2.230100    
 H  -7.7799998E-02   1.103000       2.053300    
 H    1.257300      -2.674500       1.212300    
 H    2.560600       4.019000     -0.9569000    
 H    5.575400      -1.231300     -0.6972000    
 H   8.5000001E-02   3.501600       2.498700    
 H    3.256200      -4.028300       1.547700    
 H    1.418600       4.967200       1.010800    
 H    5.431400      -3.309800      0.5998000    


%chk=000165829-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000165829

1 1
O -0.194584 -0.785685 0.433281
N -4.352609 -0.301077 0.356813
C -3.604587 0.583981 -0.703316
C -3.814425 -1.715882 -0.058973
C -3.873935 -0.193113 -2.022565
C -4.009312 -1.698422 -1.601497
C -2.104949 0.646155 -0.347694
C -2.331532 -1.839807 0.340135
C -1.437975 -0.765731 -0.330233
C -4.078372 0.079781 1.803382
C -5.863927 -0.219610 0.158976
C 0.957387 -0.117227 -0.222096
C 1.185932 1.273234 0.373876
C 2.203114 -1.017511 -0.116783
C 1.985000 2.191718 -0.362661
C 3.456196 -0.620632 -0.674682
C 2.646438 1.736161 -1.651711
C 3.774142 0.698407 -1.398702
C 0.662876 1.639672 1.634678
C 2.094201 -2.266992 0.545095
C 2.208450 3.484001 0.170150
C 4.552782 -1.515799 -0.547346
C 0.904976 2.928294 2.162753
C 3.198549 -3.135339 0.663402
C 1.670286 3.857978 1.422641
C 4.440630 -2.757244 0.108270
H -4.064098 1.587392 -0.680601
H -4.431868 -2.471722 0.456023
H -3.038045 -0.036528 -2.722586
H -4.782518 0.169908 -2.529949
H -4.986740 -2.115147 -1.894194
H -3.241442 -2.328202 -2.077993
H -1.614187 1.286432 -1.103303
H -1.934428 1.153516 0.617043
H -2.192557 -1.795586 1.434402
H -1.985117 -2.843363 0.035780
H -1.227137 -1.069279 -1.379462
H -3.008486 0.036986 2.027960
H -4.618920 -0.620674 2.459290
H -4.446608 1.104026 1.972225
H -6.193970 0.807986 0.376949
H -6.350434 -0.920803 0.854805
H -6.133022 -0.479981 -0.871312
H 0.704518 -0.009578 -1.301040
H 1.902701 1.310921 -2.356234
H 3.096471 2.603300 -2.168411
H 4.569390 1.207349 -0.817642
H 4.231042 0.446567 -2.376526
H 0.092584 0.899855 2.206507
H 1.128268 -2.547051 0.971863
H 2.819224 4.197910 -0.395220
H 5.519688 -1.220471 -0.974041
H 0.511803 3.201196 3.148291
H 3.090844 -4.093563 1.182946
H 1.860100 4.859318 1.823701
H 5.310385 -3.418029 0.187035


