%chk=000145349.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145349

0 1
 S    1.636600     -1.9999999E-04  -1.534200    
 S    1.638200      3.0000001E-04   1.535400    
 N  -0.2396000       1.260700      1.4000000E-03
 N  -0.2397000      -1.260600      1.7000000E-03
 C   0.5441000      9.9999997E-05  1.2000001E-03
 C   -2.329300       0.000000      6.0000003E-04
 C   -1.635400       1.230700      8.9999998E-04
 C   -1.635300      -1.230600      7.9999998E-04
 C   -3.758700     -9.9999997E-05 -3.9999999E-04
 C   0.4425000       2.560200      3.9999999E-04
 C   0.4423000      -2.560200      1.6000000E-03
 C    3.203200     -9.9999997E-05 -0.6981000    
 C    3.204000      9.9999997E-05  0.6976000    
 C   -2.401400       2.419100      9.9999997E-05
 C   -2.401300      -2.419100     -1.9999999E-04
 C   -4.469500       1.201900     -1.1000000E-03
 C   -4.469500      -1.202000     -1.1000000E-03
 C   -3.793200       2.408700     -1.1000000E-03
 C   -3.793200      -2.408800     -1.1000000E-03
 C    4.409900     -3.9999999E-04  -1.399200    
 C    4.411300      3.0000001E-04   1.397600    
 C    5.616700     -3.0000001E-04 -0.6990000    
 C    5.617400      1.9999999E-04  0.6962000    
 H   0.1810000       3.135000     -0.8954000    
 H    1.532800       2.472800      7.9999998E-04
 H   0.1804000       3.136600      0.8950000    
 H   0.1811000      -3.135300     -0.8941000    
 H   0.1797000      -3.136200      0.8964000    
 H    1.532500      -2.472800      2.4999999E-03
 H   -1.927400       3.397800      1.9999999E-04
 H   -1.927200      -3.397800     -1.9999999E-04
 H   -5.557300       1.211100     -2.0999999E-03
 H   -5.557300      -1.211200     -2.0000001E-03
 H   -4.344600       3.344300     -1.7000000E-03
 H   -4.344400      -3.344400     -1.8000000E-03
 H    4.426500     -6.9999998E-04  -2.486000    
 H    4.429000      5.0000002E-04   2.484300    
 H    6.557900     -5.0000002E-04  -1.241200    
 H    6.559200      3.0000001E-04   1.237500    


%chk=000145349-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000145349

0 1
S 1.709582 -0.000145 -1.592999
S 1.710251 0.000023 1.593255
N -0.303077 1.201879 0.000603
N -0.303037 -1.201804 0.000863
C 0.457489 0.000030 0.000549
C -2.439612 0.000003 0.000126
C -1.718478 1.241067 0.000192
C -1.718450 -1.241044 0.000356
C -3.881318 -0.000009 -0.000316
C 0.433643 2.478374 -0.000276
C 0.433795 -2.478223 0.000623
C 3.297230 -0.000131 -0.710921
C 3.297544 -0.000051 0.710469
C -2.425857 2.459247 -0.000274
C -2.425811 -2.459238 0.000104
C -4.572848 1.255675 -0.000639
C -4.572825 -1.255707 -0.000452
C -3.851138 2.450302 -0.000633
C -3.851093 -2.450318 -0.000259
C 4.523426 -0.000194 -1.416713
C 4.524017 -0.000033 1.415767
C 5.745478 -0.000176 -0.708188
C 5.745776 -0.000094 0.706733
H 0.183855 3.064901 -0.903472
H 1.513852 2.284061 0.000121
H 0.183477 3.066301 0.901897
H 0.184470 -3.065030 -0.902522
H 0.183315 -3.065923 0.902855
H 1.513981 -2.283758 0.001447
H -1.902568 3.417128 -0.000372
H -1.902515 -3.417113 0.000166
H -5.668051 1.260558 -0.000957
H -5.668028 -1.260609 -0.000763
H -4.380075 3.409930 -0.000951
H -4.380018 -3.409953 -0.000425
H 4.521517 -0.000253 -2.511694
H 4.522572 0.000032 2.510749
H 6.690501 -0.000225 -1.261540
H 6.691029 -0.000079 1.259692


