%chk=000094280.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094280

0 1
 N  -0.1417000      0.3139000      0.3835000    
 N   -4.494300      0.5827000      4.7499999E-02
 C    2.480700     -0.6796000     -0.3893000    
 C    1.300000      -1.609600     -4.5299999E-02
 C    2.203000      0.8068000     -8.7399997E-02
 C   4.7899999E-02  -1.085200      0.3456000    
 C   0.9183000       1.244000      0.3049000    
 C    3.715400      -1.126500      0.4413000    
 C    2.787700     -0.8204000      -1.898000    
 C   -1.510500      0.8278000      0.5129000    
 C   -2.212300      0.9711000     -0.8362000    
 C    1.456400      -3.011900     -0.1400000    
 C    3.239600       1.759200     -0.2222000    
 C  -0.9709000      -1.997300      0.7000000    
 C   0.7512000       2.611100      0.6196000    
 C   -3.656700       1.472200     -0.7478000    
 C   0.4253000      -3.886800      0.1897000    
 C    3.038500       3.105400      6.8999998E-02
 C  -0.7867000      -3.378300      0.6227000    
 C    1.794900       3.529800      0.5028000    
 C   -4.537900     -0.7540000     -0.5483000    
 C   -5.847900       1.125700      0.1749000    
 H    3.518700      -1.034000       1.516800    
 H    3.999400      -2.166300      0.2488000    
 H    4.609400     -0.5345000      0.2200000    
 H    3.027600      -1.853500      -2.174300    
 H    1.929000     -0.5103000      -2.506600    
 H    3.642800     -0.2066000      -2.202900    
 H   -1.571300       1.782400       1.038700    
 H   -2.105300      0.2126000       1.192100    
 H   -2.149900      3.8400002E-02  -1.408000    
 H   -1.650500       1.699400      -1.437200    
 H    2.394600      -3.445000     -0.4777000    
 H    4.228100       1.460600     -0.5620000    
 H   -1.945600      -1.684900       1.054200    
 H  -0.1862000       3.034800      0.9593000    
 H   -4.056600       1.593600      -1.763200    
 H   -3.642100       2.469900     -0.2906000    
 H   0.5744000      -4.959400      0.1145000    
 H    3.853600       3.814700     -3.7300002E-02
 H   -1.594500      -4.050800      0.8961000    
 H    1.628600       4.575600      0.7436000    
 H   -3.574200      -1.264600     -0.5142000    
 H   -4.884800     -0.7314000      -1.588100    
 H   -5.223700      -1.396400      1.7500000E-02
 H   -5.823800       2.110700      0.6544000    
 H   -6.462500      0.4822000      0.8143000    
 H   -6.346700       1.226200     -0.7959000    


%chk=000094280-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000094280

0 1
N -0.054249 0.441232 0.224869
N -4.342150 0.168214 0.267767
C 2.564325 -0.723584 -0.018889
C 1.297377 -1.547971 -0.315050
C 2.306183 0.741881 -0.415800
C 0.020458 -0.950605 -0.066781
C 1.008934 1.297187 -0.171360
C 2.790252 -0.754663 1.536041
C 3.823872 -1.308519 -0.699824
C -1.354699 1.020851 0.621300
C -2.300271 1.384058 -0.557209
C 1.343954 -2.908662 -0.690831
C 3.328012 1.595306 -0.886955
C -1.155233 -1.752847 -0.124142
C 0.806738 2.696138 -0.340628
C -3.764179 1.495098 -0.078289
C 0.176543 -3.700431 -0.777967
C 3.121070 2.980728 -1.074467
C -1.070673 -3.117362 -0.468697
C 1.855938 3.529684 -0.777015
C -4.763644 -0.594064 -0.928492
C -5.434294 0.259325 1.260826
H 1.915196 -0.346864 2.071739
H 2.950532 -1.794445 1.876357
H 3.674999 -0.148013 1.804202
H 4.011990 -2.339563 -0.353803
H 3.727100 -1.318928 -1.800337
H 4.721405 -0.724487 -0.431907
H -1.161029 1.915177 1.241347
H -1.875325 0.293339 1.266931
H -2.215243 0.612503 -1.344004
H -1.994663 2.338300 -1.025702
H 2.311625 -3.373786 -0.901596
H 4.318334 1.179733 -1.095546
H -2.138045 -1.323763 0.094962
H -0.172503 3.142563 -0.152486
H -4.379531 2.017854 -0.852909
H -3.798682 2.128143 0.830756
H 0.245069 -4.755131 -1.064920
H 3.936718 3.617478 -1.432764
H -1.986936 -3.718111 -0.504037
H 1.674669 4.603755 -0.898514
H -3.921888 -0.701052 -1.633695
H -5.612115 -0.108448 -1.473564
H -5.082901 -1.608300 -0.628779
H -5.068246 0.755701 2.176921
H -5.770560 -0.756881 1.535048
H -6.325732 0.825731 0.890092


