%chk=000007701.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007701

0 1
 N    8.370400      -1.364800     -0.4361000    
 C   -2.995400     -3.7000000E-02 -0.3417000    
 C   -1.789900      0.7780000      0.1393000    
 C   -4.338800      0.5256000      0.1285000    
 C  -0.4123000      0.2088000     -0.2227000    
 C   -5.532000     -0.3407000     -0.2921000    
 C   0.7922000      0.9874000      0.3158000    
 C   -6.877300      0.2347000      0.1625000    
 C    2.140000      0.3422000     -2.3200000E-02
 C   -8.071300     -0.6536000     -0.1986000    
 C    3.331400       1.146000      0.5133000    
 C   -9.415000     -6.3900001E-02  0.2313000    
 C    4.663500      0.4822000      0.2622000    
 C   -10.56940     -0.9746000     -0.1578000    
 C    5.191300     -0.4009000       1.204300    
 C    5.366800      0.7515000     -0.9119000    
 C    6.422400      -1.014300      0.9724000    
 C    6.597800      0.1381000      -1.143900    
 C    7.125600     -0.7447000     -0.2017000    
 H   -2.983000     -8.5100003E-02  -1.437200    
 H   -2.892600      -1.067100      2.1100000E-02
 H   -1.845800      0.8729000       1.231200    
 H   -1.866900       1.795800     -0.2631000    
 H   -4.330700      0.6158000       1.221700    
 H   -4.465300       1.538400     -0.2731000    
 H  -0.3351000      0.1470000      -1.315500    
 H  -0.3560000     -0.8220000      0.1494000    
 H   -5.536000     -0.4476000      -1.383700    
 H   -5.409900      -1.347300      0.1262000    
 H   0.7012000       1.076000       1.405400    
 H   0.7663000       2.007000     -8.7899998E-02
 H   -6.857900      0.3815000       1.249500    
 H   -7.014100       1.225300     -0.2884000    
 H    2.230100      0.2364000      -1.111700    
 H    2.165200     -0.6735000      0.3917000    
 H   -7.940400      -1.637500      0.2688000    
 H   -8.079100     -0.8173000      -1.283400    
 H    3.211600       1.309200       1.592300    
 H    3.334100       2.147400      6.3600004E-02
 H   -9.423200      8.7899998E-02   1.316800    
 H   -9.556000      0.9177000     -0.2354000    
 H   -10.60620      -1.120200      -1.242100    
 H   -10.47280      -1.955700      0.3181000    
 H   -11.52100     -0.5360000      0.1585000    
 H    4.651700     -0.6202000       2.121800    
 H    4.964800       1.436100      -1.654000    
 H    6.822900      -1.700800       1.714000    
 H    7.136100      0.3560000      -2.062900    
 H    8.881100      -1.169200      -1.286800    
 H    8.753900      -2.004400      0.2469000    


%chk=000007701-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000007701

0 1
N 8.423447 -1.403634 -0.554536
C -2.981684 -0.101206 -0.189642
C -1.781109 0.770650 0.242314
C -4.350860 0.511766 0.181507
C -0.411694 0.132278 -0.083304
C -5.550817 -0.361618 -0.249144
C 0.789516 1.001286 0.352683
C -6.918772 0.230910 0.158184
C 2.156414 0.342492 0.062594
C -8.118836 -0.643186 -0.270747
C 3.360395 1.215877 0.513597
C -9.485621 -0.059814 0.154923
C 4.706643 0.558234 0.247717
C -10.678847 -0.940054 -0.275999
C 5.263871 -0.372203 1.162972
C 5.433473 0.812301 -0.943522
C 6.486626 -1.024598 0.908349
C 6.658330 0.170618 -1.218112
C 7.206607 -0.763436 -0.293089
H -2.938479 -0.268049 -1.286410
H -2.892027 -1.103581 0.279706
H -1.843168 0.962258 1.334299
H -1.851124 1.762936 -0.250818
H -4.392073 0.673329 1.279314
H -4.442553 1.516134 -0.282943
H -0.346549 -0.063001 -1.174150
H -0.344376 -0.858594 0.412983
H -5.525138 -0.503493 -1.350001
H -5.444157 -1.373387 0.195898
H 0.710587 1.215669 1.439644
H 0.738251 1.984518 -0.160932
H -6.942822 0.369718 1.259625
H -7.026778 1.243768 -0.283959
H 2.249526 0.131505 -1.022141
H 2.212191 -0.639761 0.574590
H -8.005468 -1.659643 0.161787
H -8.104305 -0.772642 -1.373417
H 3.248808 1.431623 1.595629
H 3.304641 2.191242 -0.010004
H -9.498360 0.069169 1.256679
H -9.598657 0.955690 -0.277238
H -10.705867 -1.059494 -1.375738
H -10.605986 -1.950949 0.168159
H -11.643153 -0.500811 0.039928
H 4.731572 -0.587468 2.098793
H 5.034808 1.530618 -1.671689
H 6.892787 -1.734784 1.640022
H 7.198081 0.393471 -2.147396
H 8.935669 -1.217677 -1.411080
H 8.814036 -2.068479 0.105816


