%chk=000118764.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000118764

0 1
N -4.547267 -0.160263 0.739653
N -4.357026 -0.196485 -1.521635
C 1.268047 0.624380 -0.301636
C 2.605895 0.748425 0.439760
C 0.157035 1.410113 0.408248
C 3.715167 -0.038645 -0.271185
C -1.177812 1.281730 -0.336088
C 5.053872 0.084254 0.469087
C -2.294297 2.060765 0.371309
C 6.162202 -0.703247 -0.242325
C -3.632829 1.948169 -0.373749
C 7.502352 -0.581388 0.496641
C -4.158999 0.557773 -0.418173
C 8.609084 -1.363309 -0.207624
C -5.000374 -1.424961 0.306439
C -4.876516 -1.421289 -1.083681
C -5.486349 -2.457967 1.239198
H 1.378755 0.986282 -1.342274
H 0.980288 -0.441699 -0.385137
H 2.894014 1.814213 0.520719
H 2.495195 0.385927 1.479770
H 0.046836 1.046969 1.447957
H 0.444186 2.476197 0.488605
H 3.825889 0.323504 -1.311573
H 3.426968 -1.104449 -0.353395
H -1.464495 0.214331 -0.427409
H -1.069575 1.641377 -1.378188
H 4.943191 -0.278035 1.509241
H 5.342297 1.149979 0.550143
H -2.403563 1.702682 1.412038
H -2.015071 3.130530 0.447702
H 6.273852 -0.342234 -1.282786
H 5.875161 -1.769137 -0.324592
H -3.511415 2.313464 -1.421593
H -4.384184 2.623338 0.086695
H 7.791706 0.484665 0.577466
H 7.392559 -0.944572 1.537172
H 8.370868 -2.431121 -0.271372
H 9.561132 -1.270700 0.326577
H 8.769921 -1.002731 -1.229978
H -4.492212 0.148669 1.689608
H -5.121002 -2.198622 -1.783654
H -4.710312 -2.763993 1.956746
H -6.360812 -2.117041 1.813499
H -5.795063 -3.365650 0.696372


%chk=000118764-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000118764

0 1
N -4.635259 -0.162323 0.701247
N -4.492390 -0.150216 -1.546900
C 1.272677 0.602156 -0.279055
C 2.633958 0.729742 0.440704
C 0.138721 1.392954 0.411508
C 3.767878 -0.061640 -0.249066
C -1.217344 1.276275 -0.319225
C 5.132923 0.079499 0.461389
C -2.345801 2.073032 0.370968
C 6.267597 -0.711556 -0.227645
C -3.712021 1.969426 -0.364812
C 7.634909 -0.560534 0.477588
C -4.270914 0.575593 -0.430003
C 8.762900 -1.354327 -0.216573
C -5.113938 -1.418980 0.285973
C -5.015519 -1.381479 -1.107583
C -5.598097 -2.472540 1.238998
H 1.377685 0.953805 -1.326670
H 0.987610 -0.468916 -0.339766
H 2.918443 1.801605 0.497924
H 2.529311 0.380507 1.489596
H 0.026668 1.033608 1.456626
H 0.429163 2.462706 0.481347
H 3.865494 0.280576 -1.300704
H 3.488826 -1.135150 -0.297444
H -1.511066 0.210122 -0.393789
H -1.107778 1.636243 -1.362898
H 5.035897 -0.261182 1.513782
H 5.411543 1.153414 0.507737
H -2.453692 1.725698 1.420794
H -2.060062 3.142889 0.427517
H 6.361666 -0.376048 -1.281858
H 5.994372 -1.787008 -0.267958
H -3.596564 2.309731 -1.409060
H -4.440677 2.650616 0.120573
H 7.907166 0.514160 0.516219
H 7.540104 -0.894823 1.531097
H 8.529993 -2.435834 -0.238888
H 9.729416 -1.227210 0.305111
H 8.896237 -1.019698 -1.262776
H -4.564644 0.153736 1.667845
H -5.286483 -2.161412 -1.816001
H -4.807113 -2.797755 1.942377
H -6.461269 -2.128090 1.841046
H -5.923228 -3.361175 0.673306


