%chk=20_rad_neutro.chk
%Mem=12000MB
%NProc=12
#p wB97xD/Def2SVP opt freq SCF=(XQC) gfprint gfinput

coments

0 2
 C -0.96247900 -0.28885800 0.11137900
 C -1.88819200 0.59111600 0.80241000
 C -1.44038400 1.62667500 1.67199800
 H -0.36625800 1.76364900 1.79890000
 C -2.31524700 2.46587800 2.35717600
 H -1.92036000 3.25087200 3.00776000
 C -3.70279300 2.28056000 2.22467500
 H -4.40446900 2.91162300 2.77712500
 C -4.19408600 1.26151600 1.40349000
 H -5.27197900 1.10108600 1.35238700
 C -3.31119400 0.42278400 0.68480000
 N -3.80749200 -0.57740500 -0.15758100
 C -2.97847500 -1.61484500 -0.60062200
 C -3.54299900 -2.78416400 -1.16035900
 H -4.62480900 -2.92513500 -1.16339300
 C -2.73096400 -3.79378400 -1.68458100
 H -3.19097300 -4.69193300 -2.10582400
 C -1.33317300 -3.64384700 -1.66297000
 H -0.68609400 -4.41634900 -2.08764400
 C -0.76725300 -2.50922900 -1.08756900
 H 0.31783200 -2.41267000 -1.06482700
 C -1.54774100 -1.46806300 -0.50392500
 C 1.69521500 -1.04587900 0.21131800
 C 1.71130100 -1.87328000 1.37708900
 C 2.75762600 -2.78965400 1.58081200
 H 2.75861500 -3.39546300 2.49505900
 C 3.79661800 -2.95687900 0.65021200
 C 3.76736600 -2.15899900 -0.50529200
 H 4.56063500 -2.27561100 -1.25382200
 C 2.75491800 -1.20999400 -0.73388600
 C 0.62831200 -1.79231600 2.43760500
 H 0.90025300 -2.39584900 3.31881600
 H -0.33544100 -2.17070700 2.05780200
 H 0.44631400 -0.76143100 2.78364400
 C 4.88733500 -3.98173100 0.86835700
 H 4.61001600 -4.95832500 0.43097700
 H 5.07745200 -4.14835500 1.94117500
 H 5.83445400 -3.67179700 0.39719000
 C 2.81280300 -0.40940000 -2.02216400
 H 1.85036700 -0.42151200 -2.56034900
 H 3.57796400 -0.81924900 -2.70138600
 H 3.05726200 0.64941900 -1.83735100
 C 1.01285500 1.55765200 -0.28488700
 C 2.02939500 2.21313600 0.48163500
 C 2.42107400 3.52525900 0.16768000
 H 3.18816500 4.00967900 0.78428600
 C 1.86843400 4.23297300 -0.91343900
 C 0.88876400 3.58244800 -1.67729400
 H 0.45065600 4.10579700 -2.53574300
 C 0.44461900 2.28062000 -1.37894600
 C 2.70350600 1.55194200 1.67100100
 H 1.98164900 1.07810100 2.35666000
 H 3.27523600 2.29310300 2.25296700
 H 3.40218700 0.75872000 1.35813500
 C -0.62551100 1.69433300 -2.28323000
 H -1.61578500 1.70565600 -1.79634500
 H -0.42207900 0.64888200 -2.56348300
 H -0.70896900 2.28117400 -3.21282600
 C 2.30683000 5.64620400 -1.22645400
 H 1.92488800 6.35923400 -0.47371400
 H 1.93735700 5.97499500 -2.21090100
 H 3.40634000 5.73866900 -1.22757200
 C -5.21842600 -0.56922400 -0.53635900
 H -5.32784100 -1.01006200 -1.53641700
 H -5.57335800 0.46881100 -0.58893400
 H -5.85301500 -1.12997900 0.17470600
 B 0.56558000 0.05781800 0.01961200 

--Link1--
%chk=20_rad_neutro.chk
%Mem=12000MB
%NProc=12
#p wB97xD/def2TZVPP guess=read geom=allcheck SCF=(XQC) gfprint gfinput