%chk=000006127.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006127

1 1
 N   -3.676200     -1.8800000E-02  0.1242000    
 C   -2.826100       1.251200      0.2943000    
 C   -2.812200      -1.275400      0.3199000    
 C   -1.610300       1.250800     -0.6291000    
 C   -1.596600      -1.280600     -0.6035000    
 C  -0.8083000     -8.9999996E-03 -0.4618000    
 C   -4.386400     -3.6499999E-02  -1.228500    
 C   -4.760500     -1.3700000E-02   1.209000    
 C   0.5034000      7.9999998E-04 -0.1845000    
 C    1.186900      -1.264600     -4.2399999E-02
 C    1.167300       1.276500     -4.1299999E-02
 C    1.270800      -1.885900       1.209000    
 C    1.742400       1.902800      -1.153200    
 C    1.771600      -1.881100      -1.154600    
 C    1.241800       1.898100       1.210500    
 C    1.930700      -3.107000       1.346400    
 C    2.383400       3.133800      -1.015000    
 C    2.431300      -3.102400      -1.017100    
 C    1.882800       3.129300       1.348600    
 C    2.510800      -3.715300      0.2334000    
 C    2.453600       3.747000      0.2357000    
 H   -2.509300       1.287900       1.344100    
 H   -3.475100       2.110900      9.2100002E-02
 H   -3.451700      -2.146200      0.1356000    
 H   -2.494900      -1.287300       1.370200    
 H   -1.063200       2.177200     -0.4382000    
 H   -1.930500       1.322400      -1.675600    
 H   -1.915800      -1.376900      -1.648300    
 H   -1.039400      -2.196800     -0.3938000    
 H   -5.013400      0.8574000      -1.298900    
 H   -3.650500     -4.0500000E-02  -2.033800    
 H   -5.003300     -0.9386000      -1.280700    
 H   -5.366100     -0.9178000       1.095800    
 H   -4.273400     -1.0000000E-03   2.188500    
 H   -5.376000      0.8814000       1.077500    
 H   0.8231000      -1.427600       2.088100    
 H    1.696700       1.440500      -2.136700    
 H    1.719000      -1.419000      -2.137900    
 H   0.8014000       1.432400       2.089300    
 H    1.992200      -3.584600       2.319900    
 H    2.827500       3.615300      -1.881300    
 H    2.882800      -3.576400      -1.883700    
 H    1.937100       3.607200       2.322200    
 H    3.024400      -4.666300      0.3403000    
 H    2.952400       4.705700      0.3432000    


%chk=000006127-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000006127

1 1
N -3.880657 0.013672 0.077222
C -3.000182 1.289008 0.157950
C -2.999760 -1.230950 0.354493
C -1.750793 1.202612 -0.734197
C -1.758418 -1.316991 -0.556158
C -0.923014 -0.046727 -0.462680
C -4.549114 -0.093316 -1.289257
C -4.968243 0.096650 1.143258
C 0.426105 -0.027597 -0.180638
C 1.254552 -1.276639 -0.133834
C 1.163164 1.252448 0.091971
C 2.172539 -1.484202 0.933120
C 2.344107 1.565093 -0.634685
C 1.185540 -2.251751 -1.168173
C 0.734020 2.150487 1.108220
C 2.965592 -2.649953 0.984906
C 3.051467 2.759259 -0.378899
C 1.990178 -3.410699 -1.124226
C 1.448794 3.338989 1.374283
C 2.876147 -3.619171 -0.042154
C 2.605800 3.651891 0.624211
H -2.711253 1.387122 1.219196
H -3.652987 2.136145 -0.117411
H -3.656343 -2.111594 0.241395
H -2.688456 -1.148532 1.410879
H -1.162170 2.118882 -0.563376
H -2.050512 1.229660 -1.803084
H -2.066054 -1.536120 -1.599147
H -1.181271 -2.194635 -0.217597
H -5.185132 0.791937 -1.444337
H -3.787131 -0.141978 -2.077310
H -5.164755 -1.005798 -1.313215
H -5.601273 -0.802572 1.087193
H -4.496900 0.157115 2.135956
H -5.579798 0.995126 0.966465
H 2.260996 -0.728976 1.722091
H 2.703693 0.870609 -1.402036
H 0.535069 -2.077845 -2.033873
H -0.137736 1.892107 1.723318
H 3.659580 -2.798730 1.818911
H 3.953327 2.990334 -0.955504
H 1.937641 -4.141983 -1.937909
H 1.114374 4.011610 2.171563
H 3.501424 -4.517498 -0.007151
H 3.162045 4.572799 0.828151


