%chk=000161708.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161708

1 1
 N    1.522700      0.9022000      0.3479000    
 N   -4.851400     -0.4931000      4.0199999E-02
 N   0.3622000       5.518200     -0.5058000    
 C   0.8089000     -0.1743000      0.1461000    
 C    2.951500     -0.8266000      6.0100000E-02
 C    2.882600      0.5163000      0.3009000    
 C    1.691000      -1.336000     -5.2000001E-02
 C    4.125000      -1.564300     -4.8700001E-02
 C    1.153500       2.305000      0.5571000    
 C  -0.6515000     -0.2560000      0.1188000    
 C    4.040600       1.252000      0.4535000    
 C    1.502000      -2.682300     -0.2797000    
 C    5.317300     -0.8262000      0.1031000    
 C    3.950900      -2.942900     -0.2918000    
 C   -1.365300     -0.5061000       1.295100    
 C   -1.344600     -8.5400000E-02  -1.083800    
 C    5.265400      0.5657000      0.3511000    
 C    2.649600      -3.486800     -0.4029000    
 C    1.077800       3.004100     -0.7912000    
 C   -3.443600     -0.4135000      6.6500001E-02
 C   -2.757600     -0.5848000       1.269000    
 C   -2.737000     -0.1639000      -1.110000    
 C   -5.594900     -0.7523000       1.257200    
 C   -5.574300     -0.3028000      -1.201600    
 C   -5.927200      0.5531000       1.954200    
 C   -5.731600      -1.627800      -1.922700    
 C   0.6778000       4.408500     -0.6304000    
 H   0.1774000       2.322700       1.056700    
 H    1.864300       2.779500       1.243000    
 H    4.037100       2.319500      0.6413000    
 H   0.5121000      -3.115400     -0.3646000    
 H    6.282700      -1.320600      3.2499999E-02
 H    4.813500      -3.596700     -0.3914000    
 H  -0.8415000     -0.6372000       2.238800    
 H  -0.8042000      0.1046000      -2.008100    
 H    6.195500       1.117600      0.4653000    
 H    2.535200      -4.552500     -0.5864000    
 H    2.047100       2.965100      -1.303200    
 H   0.3593000       2.501200      -1.449600    
 H   -3.244500     -0.7633000       2.220800    
 H   -3.205400     -3.9500002E-02  -2.079500    
 H   -6.545500      -1.237700      0.9979000    
 H   -5.113700      -1.469600       1.929400    
 H   -6.582600      6.9700003E-02 -0.9757000    
 H   -5.151000      0.4725000      -1.848200    
 H   -6.531400      0.3615000       2.846600    
 H   -6.497000       1.221100       1.299400    
 H   -5.024400       1.086800       2.267600    
 H   -6.320000      -1.493300      -2.835900    
 H   -6.246900      -2.363300      -1.295800    
 H   -4.764000      -2.053700      -2.205900    


%chk=000161708-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161708

1 1
N 1.559493 0.780077 0.662437
N -4.940833 -0.517709 -0.010773
N 0.602305 5.593182 0.700627
C 0.771841 -0.225644 0.083416
C 3.005928 -0.778416 -0.165093
C 2.947774 0.453210 0.523367
C 1.691855 -1.236274 -0.458907
C 4.205377 -1.465763 -0.460234
C 1.126874 2.134122 1.066858
C -0.670344 -0.267124 0.081716
C 4.127865 1.081844 0.936336
C 1.556732 -2.502071 -1.069225
C 5.421996 -0.819045 -0.044950
C 4.041885 -2.729682 -1.119214
C -1.474416 0.180605 1.183983
C -1.367152 -0.831561 -1.039421
C 5.364081 0.416475 0.626029
C 2.746762 -3.220274 -1.401432
C 1.394105 3.169857 -0.070530
C -3.566005 -0.445655 0.021444
C -2.863488 0.085699 1.165740
C -2.757001 -0.905599 -1.082163
C -5.783278 -0.118966 1.149612
C -5.678090 -1.003431 -1.208627
C -6.102683 1.391798 1.175669
C -5.842965 -2.538824 -1.234412
C 0.962966 4.514201 0.343377
H 0.054676 2.130102 1.298282
H 1.669159 2.423349 1.983298
H 4.145779 2.027732 1.487039
H 0.580961 -2.950494 -1.278125
H 6.391512 -1.289620 -0.238542
H 4.918894 -3.326647 -1.392938
H -0.994610 0.526022 2.106120
H -0.797525 -1.159881 -1.915086
H 6.296876 0.893821 0.942295
H 2.647269 -4.196396 -1.886622
H 2.467196 3.196731 -0.333550
H 0.839119 2.875309 -0.980541
H -3.416865 0.414610 2.048063
H -3.227877 -1.320936 -1.976015
H -6.721204 -0.697913 1.082682
H -5.293476 -0.434678 2.087382
H -6.671393 -0.521181 -1.196645
H -5.172487 -0.645244 -2.122296
H -6.754544 1.622837 2.036596
H -6.631224 1.702897 0.257454
H -5.186629 2.001095 1.264024
H -6.414589 -2.840918 -2.129658
H -6.392679 -2.894600 -0.345282
H -4.866026 -3.052028 -1.258362


