%chk=000029165.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029165

0 1
 O    1.488300      -2.587600     -0.4161000    
 N  -7.9499997E-02 -7.7500001E-02 -0.4720000    
 N    3.465800       1.002700     -2.7000001E-03
 C   -1.855600      -1.280700      0.1119000    
 C  -0.5068000      -1.344300     -0.1812000    
 C   -2.645900      -2.488900      0.4808000    
 C   -2.264200      7.6800004E-02 -1.7300000E-02
 C   -1.130900      0.8087000     -0.3833000    
 C   -1.716000      -3.583800       1.029000    
 C    1.274300      0.2947000     -0.8286000    
 C  -0.5036000      -3.828100      0.1176000    
 C   0.2862000      -2.551200     -0.1662000    
 C    2.106700      0.6600000      0.3970000    
 C   -3.487800      0.7586000      0.1411000    
 C   -1.162600       2.191500     -0.5979000    
 C   -3.533400       2.141200     -7.0799999E-02
 C   -2.387300       2.844700     -0.4345000    
 C    4.105100     -0.1276000     -0.6792000    
 C    4.257600       1.412100       1.158900    
 C   -4.826600       2.868000      9.5200002E-02
 C    5.495900      0.2293000      -1.162000    
 C    3.620400       2.581500       1.880500    
 H   -3.402400      -2.241000       1.233400    
 H   -3.170000      -2.859700     -0.4082000    
 H    1.659000     -0.5271000      -1.431300    
 H    1.219400       1.146300      -1.517900    
 H   -1.356700      -3.283400       2.022300    
 H   -2.278500      -4.515200       1.158700    
 H  -0.8290000      -4.242500     -0.8434000    
 H   0.1677000      -4.551000      0.5939000    
 H    1.601900       1.508000      0.8718000    
 H    2.100200     -0.1637000       1.123400    
 H   -4.383700      0.2117000      0.4230000    
 H  -0.2776000       2.753000     -0.8767000    
 H   -2.431900       3.919200     -0.5982000    
 H    4.149200      -1.017300     -3.8699999E-02
 H    3.573200     -0.4041000      -1.592000    
 H    4.408500      0.5838000       1.862700    
 H    5.246300       1.762000      0.8442000    
 H   -4.661400       3.898200      0.4287000    
 H   -5.369600       2.889400     -0.8548000    
 H   -5.457300       2.385300      0.8496000    
 H    5.506900       1.181200      -1.704100    
 H    6.223600      0.2770000     -0.3460000    
 H    5.855800     -0.5421000      -1.852700    
 H    3.322800       3.376200       1.187700    
 H    2.752500       2.284500       2.477500    
 H    4.342000       3.016800       2.581500    


%chk=000029165-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029165

0 1
O 1.503124 -2.613297 -0.645619
N -0.072280 -0.029382 -0.449055
N 3.572259 0.826768 0.205765
C -1.918993 -1.332958 0.028037
C -0.536309 -1.353900 -0.272982
C -2.717494 -2.588655 0.268722
C -2.325017 0.044079 0.046768
C -1.150059 0.832766 -0.244551
C -1.776238 -3.744304 0.694657
C 1.313976 0.390499 -0.730594
C -0.565007 -3.873633 -0.260997
C 0.249979 -2.578694 -0.404582
C 2.161427 0.550199 0.557663
C -3.566445 0.698168 0.290533
C -1.209672 2.246800 -0.293551
C -3.639525 2.101642 0.243595
C -2.451242 2.856046 -0.050169
C 4.357106 -0.419785 -0.029050
C 4.245282 1.788621 1.115656
C -4.946104 2.835609 0.495266
C 5.507767 -0.219959 -1.033620
C 3.785164 3.242958 0.897668
H -3.491664 -2.418109 1.041180
H -3.260903 -2.877155 -0.656659
H 1.782702 -0.368220 -1.374829
H 1.293883 1.348089 -1.278751
H -1.408389 -3.552040 1.721449
H -2.333561 -4.699643 0.720206
H -0.919535 -4.154993 -1.275546
H 0.128368 -4.668673 0.066037
H 1.756658 1.385636 1.157672
H 2.055367 -0.374967 1.170666
H -4.465145 0.109967 0.511291
H -0.324095 2.852867 -0.510637
H -2.522361 3.950591 -0.082352
H 4.760660 -0.822567 0.933826
H 3.665345 -1.189434 -0.417400
H 4.106845 1.505524 2.190344
H 5.330916 1.730202 0.916145
H -4.857454 3.538784 1.345227
H -5.251571 3.430474 -0.386698
H -5.766022 2.133636 0.725505
H 5.108182 0.119869 -2.005109
H 6.237969 0.533625 -0.684609
H 6.053233 -1.169879 -1.187727
H 3.979319 3.548861 -0.145247
H 2.703809 3.365643 1.094180
H 4.326744 3.927925 1.576877


