%chk=000187306.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187306

0 1
N -0.168000 -2.916702 0.482161
N -0.047035 0.263704 -1.531465
N -2.820568 0.534752 -0.189339
N -1.625605 2.152173 1.028675
N -1.764532 -0.060400 1.954556
C -0.338795 -2.212734 -0.838472
C 0.205614 -0.824591 -0.669011
C 1.146182 -0.462075 0.288975
C 1.632454 -1.397714 1.333079
C -1.810071 -2.292737 -1.303288
C 1.240692 -2.852178 0.988341
C 1.477668 0.921728 0.073672
C 0.693785 1.362202 -1.050738
C -2.871227 -2.038087 -0.227484
C 2.341091 1.834388 0.705749
C 0.756877 2.687397 -1.524964
C -3.605496 -0.691344 -0.363316
C 2.396595 3.135498 0.235013
C 1.611059 3.556758 -0.869469
C -2.086341 0.799188 0.862809
H 0.287457 -2.701610 -1.643347
H 2.732560 -1.324151 1.447628
H 1.199596 -1.113476 2.315484
H -1.956169 -1.589989 -2.148227
H -1.978791 -3.300289 -1.735211
H 1.975496 -3.268076 0.264945
H 1.292633 -3.478533 1.905121
H -0.453050 -3.897112 0.380795
H -0.868117 0.342906 -2.113237
H -3.628650 -2.846321 -0.268520
H -2.425138 -2.128071 0.787508
H 2.950001 1.509883 1.546051
H 0.159787 3.002719 -2.374891
H -4.044728 -0.606045 -1.386165
H -4.466998 -0.685088 0.347492
H 3.055714 3.859678 0.709887
H 1.692020 4.591278 -1.201613
H -1.966187 2.785189 0.306664
H -0.617071 2.245859 1.123901
H -1.084691 0.288968 2.617674
H -1.561424 -1.031246 1.686473


%chk=000187306-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187306

0 1
N 0.468421 -3.366714 -0.126207
N 0.000986 0.313135 -0.444003
N -2.753148 0.535035 -0.054954
N -3.189310 2.500341 -1.268128
N -4.834439 1.728906 0.217353
C -0.198745 -2.232151 -0.826894
C 0.542511 -0.980983 -0.414735
C 1.860339 -0.953472 0.043188
C 2.656116 -2.216212 0.269200
C -1.724484 -2.192626 -0.551526
C 1.932105 -3.416008 -0.395399
C 2.173308 0.432219 0.327150
C 0.982073 1.196909 0.024547
C -2.142249 -1.697467 0.859263
C 3.322986 1.110099 0.813215
C 0.925597 2.595134 0.217797
C -3.222614 -0.589306 0.791842
C 3.268220 2.506804 0.998658
C 2.080450 3.242041 0.708087
C -3.565970 1.532523 -0.332759
H -0.085745 -2.346125 -1.940692
H 3.682620 -2.139790 -0.143240
H 2.759374 -2.405875 1.357001
H -2.169918 -1.518890 -1.309260
H -2.135580 -3.202530 -0.752415
H 2.147967 -3.393602 -1.494135
H 2.329316 -4.366361 0.005781
H 0.012068 -4.257632 -0.370075
H -1.046273 0.494497 -0.422591
H -2.533153 -2.531030 1.471991
H -1.256889 -1.307843 1.391995
H 4.240756 0.556542 1.045318
H 0.012979 3.162932 -0.000397
H -4.167417 -1.019450 0.383237
H -3.438961 -0.248786 1.830721
H 4.148982 3.041204 1.373844
H 2.067250 4.326733 0.867826
H -2.319406 2.336579 -1.771410
H -3.508023 3.461855 -1.167817
H -5.519862 2.319524 -0.246545
H -5.143643 1.145541 0.989064


