%chk=000153046.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153046

1 1
 N  -0.3461000     -0.6773000     -0.1829000    
 N    3.911200     -0.7904000      0.3815000    
 N   -1.588200      -5.308300     -0.3017000    
 N   -3.625200       4.394600      0.2389000    
 N    7.533300     -0.5553000     -0.4161000    
 C  -0.5825000      0.6347000     -0.1119000    
 C    1.064400      -1.116800     -0.2892000    
 C   -1.315600      -1.607200     -0.1619000    
 C   -1.879800       1.120600     -9.8000001E-03
 C   -2.667100      -1.200000     -5.9799999E-02
 C   -2.955000      0.2029000      1.8400000E-02
 C    1.634000      -1.327200       1.109500    
 C   0.5967000       1.480600     -0.1508000    
 C    3.086300      -1.793000       1.045000    
 C  -0.9627000      -2.962900     -0.2420000    
 C   -2.110600       2.504100      6.3800000E-02
 C   -3.637900      -2.231000     -4.3000001E-02
 C   -4.258200      0.7478000      0.1236000    
 C   -1.945100      -3.946600     -0.2224000    
 C   -3.405200       3.004100      0.1664000    
 C   -3.281800      -3.581400     -0.1231000    
 C   -4.479200       2.126000      0.1966000    
 C    1.235300       1.833700       1.035100    
 C    1.083400       1.934500      -1.373900    
 C    5.298100      -1.227100      0.3038000    
 C    2.368400       2.646300      0.9977000    
 C    2.216500       2.746900      -1.411400    
 C    6.153900     -0.1552000     -0.3549000    
 C    2.859000       3.102900     -0.2255000    
 H    1.157600      -1.997100     -0.9290000    
 H    1.659600     -0.4158000     -0.8733000    
 H    1.557300     -0.4634000       1.763600    
 H    1.057600      -2.108500       1.620700    
 H    3.135600      -2.745800      0.5039000    
 H    3.445900      -1.971100       2.065600    
 H   5.3500000E-02  -3.334700     -0.2760000    
 H   -1.292600       3.221100      4.3000001E-02
 H   -4.697800      -2.001900      3.3300001E-02
 H   -5.134100      0.1045000      0.1511000    
 H   -4.063700      -4.336700     -0.1061000    
 H   -5.498300       2.496100      0.2763000    
 H    3.854700      9.1100000E-02  0.8905000    
 H   0.8411000       1.529300       2.001500    
 H   0.5933000       1.666100      -2.306700    
 H    5.363500      -2.155400     -0.2776000    
 H    5.684300      -1.434800       1.310100    
 H    2.862800       2.931600       1.921600    
 H    2.598600       3.102500      -2.363800    
 H   -2.305900      -6.020800     -0.2889000    
 H  -0.6155000      -5.574900     -0.3765000    
 H    6.081300      0.7822000      0.2089000    
 H    5.787500      4.8500001E-02  -1.368100    
 H   -2.841600       5.033500      0.2176000    
 H   -4.567200       4.754800      0.3142000    
 H    3.740400       3.736700     -0.2545000    
 H    8.078600      0.1544000     -0.9032000    
 H    7.627300      -1.411400     -0.9608000    


%chk=000153046-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000153046

1 1
N -0.254764 -0.779930 -0.137940
N 3.960994 -0.905330 0.581129
N -1.875906 -5.415250 -0.176426
N -3.557514 4.416394 0.075312
N 7.419005 -0.285107 -0.822496
C -0.474328 0.574340 -0.096254
C 1.156691 -1.292247 -0.167858
C -1.322995 -1.722905 -0.119324
C -1.808591 1.105640 -0.040817
C -2.676504 -1.229562 -0.074080
C -2.929397 0.190909 -0.031895
C 1.689685 -1.699190 1.223692
C 0.699785 1.507088 -0.108389
C 3.194716 -2.045147 1.126593
C -1.057646 -3.116042 -0.147217
C -2.019156 2.518003 -0.005774
C -3.725584 -2.204784 -0.070876
C -4.241003 0.759836 0.018026
C -2.116861 -4.054126 -0.145414
C -3.322454 3.053009 0.041745
C -3.469554 -3.568579 -0.107372
C -4.435727 2.136678 0.054562
C 1.208180 2.021386 1.112276
C 1.265213 1.933743 -1.337915
C 5.365215 -1.203224 0.204675
C 2.287161 2.933875 1.102597
C 2.345434 2.843411 -1.342676
C 6.036654 0.030294 -0.438208
C 2.860773 3.342718 -0.123697
H 1.203084 -2.132305 -0.880119
H 1.819979 -0.506983 -0.555533
H 1.553130 -0.852159 1.924209
H 1.136471 -2.558520 1.644815
H 3.338539 -2.905170 0.442177
H 3.546143 -2.381274 2.131438
H -0.034559 -3.494442 -0.164308
H -1.154346 3.187295 -0.018541
H -4.766454 -1.873680 -0.041704
H -5.121897 0.112998 0.028634
H -4.299928 -4.283274 -0.106199
H -5.455295 2.538220 0.092392
H 3.912831 -0.088798 1.209301
H 0.752489 1.721754 2.063102
H 0.861819 1.557273 -2.284807
H 5.351671 -2.033738 -0.529567
H 5.995848 -1.536143 1.060060
H 2.670551 3.330622 2.048627
H 2.778922 3.164679 -2.295301
H -2.644399 -6.081489 -0.171898
H -0.930262 -5.787989 -0.211552
H 6.069445 0.849342 0.308129
H 5.386318 0.384201 -1.273535
H -2.790345 5.083805 0.065032
H -4.504384 4.785673 0.105659
H 3.695631 4.051248 -0.130225
H 8.069317 0.501319 -0.850378
H 7.522259 -0.918266 -1.618489


