%chk=000070594.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070594

0 1
 N   0.2113000      0.1295000     -7.8999996E-03
 N    1.951600       2.283200      7.9999998E-04
 N   0.6185000       2.491300     -1.5000000E-03
 N   -1.956400       2.960800     -8.9999998E-04
 C    1.541600     -4.3400001E-02 -5.4000001E-03
 C    2.409600       1.018200     -1.1000000E-03
 C    1.971500      -1.422500     -4.1999999E-03
 C   -3.864300      0.9184000     -3.0000001E-04
 C    3.846700      0.8887000      2.0000001E-03
 C   -1.603400       1.655800     -3.1000001E-03
 C  -0.1809000       1.409500     -5.7999999E-03
 C   -4.852400     -0.1384000      6.0000003E-04
 C   -2.509200      0.6073000     -3.0000000E-03
 C   -4.266800       2.249100      2.0999999E-03
 C    2.174200      -2.090600       1.204600    
 C    2.185600      -2.090300      -1.211300    
 C    4.547500      0.8285000      -1.204800    
 C    4.542800      0.8226000       1.211100    
 C   -5.325400     -0.6491000       1.209400    
 C   -5.331800     -0.6469000      -1.206500    
 C   -3.282400       3.224200      1.6000000E-03
 C    2.589700      -3.422200       1.206400    
 C    2.601000      -3.421800      -1.209500    
 C    5.936700      0.7028000      -1.202400    
 C    5.932100      0.6970000       1.213500    
 C    2.802900      -4.087800     -6.9999998E-04
 C   -6.277800      -1.668300       1.210900    
 C   -6.284100      -1.666000      -1.205000    
 C    6.629000      0.6372000      6.6000000E-03
 C   -6.757200      -2.176700      3.7000000E-03
 H   -2.194200     -0.4323000     -4.6999999E-03
 H   -5.314700       2.532000      4.3000001E-03
 H    2.012200      -1.586600       2.154600    
 H    2.032300      -1.585900      -2.162600    
 H    4.023500      0.8785000      -2.156500    
 H    4.015100      0.8680000       2.161100    
 H   -4.962200     -0.2644000       2.159600    
 H   -4.973700     -0.2602000      -2.157800    
 H   -3.543600       4.277200      3.5000001E-03
 H    2.747200      -3.940700       2.147500    
 H    2.767300      -3.940200      -2.149300    
 H    6.479300      0.6559000      -2.142100    
 H    6.471200      0.6456000       2.154900    
 H    3.126500      -5.124500      6.9999998E-04
 H   -6.646100      -2.066200       2.152000    
 H   -6.657400      -2.062000      -2.144900    
 H    7.710600      0.5392000      8.5000005E-03
 H   -7.498700      -2.970300      4.9000001E-03


%chk=000070594-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000070594

0 1
N 0.305348 0.045862 -0.238073
N 2.015341 1.923400 -1.282789
N 0.680223 2.104133 -1.443174
N -1.895302 2.924364 -0.637112
C 1.639795 -0.243400 -0.277280
C 2.534671 0.844561 -0.591282
C 2.026709 -1.661707 -0.079109
C -3.889191 0.913307 -0.130260
C 3.970562 0.940608 -0.242415
C -1.567009 1.596056 -0.539989
C -0.135480 1.239401 -0.714659
C -4.921649 -0.127332 0.135501
C -2.520235 0.577467 -0.289693
C -4.227394 2.290210 -0.240496
C 1.199958 -2.505604 0.712491
C 3.174919 -2.216227 -0.709509
C 4.840459 1.728125 -1.046969
C 4.488928 0.312882 0.924253
C -4.602869 -1.294572 0.882354
C -6.249453 0.021880 -0.350967
C -3.212083 3.239467 -0.489747
C 1.522933 -3.866985 0.884770
C 3.488977 -3.580524 -0.543603
C 6.199994 1.867567 -0.701575
C 5.848193 0.460054 1.268622
C 2.669445 -4.410418 0.258072
C -5.580131 -2.279732 1.136213
C -7.226789 -0.964097 -0.100005
C 6.711162 1.232342 0.455202
C -6.897134 -2.119595 0.645925
H -2.177504 -0.460116 -0.255853
H -5.259659 2.627418 -0.102756
H 0.310916 -2.074754 1.183392
H 3.810277 -1.586610 -1.340256
H 4.428442 2.225389 -1.930091
H 3.827321 -0.276964 1.566978
H -3.593149 -1.417104 1.290179
H -6.510501 0.897454 -0.956153
H -3.454668 4.305677 -0.563322
H 0.883404 -4.504385 1.505237
H 4.369847 -3.997907 -1.043301
H 6.860951 2.471922 -1.332509
H 6.233088 -0.022452 2.173695
H 2.920079 -5.468847 0.389698
H -5.317611 -3.167526 1.722103
H -8.241437 -0.835956 -0.492883
H 7.768008 1.341595 0.722892
H -7.655901 -2.885128 0.841850


