%chk=000108563.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108563

0 1
 N   0.8071000     -0.4578000     -2.4499999E-02
 C   -1.519900      -1.354000      0.2632000    
 C   -2.239000     -0.2294000     -0.5212000    
 C  -0.2053000     -0.8958000      0.9300000    
 C   -1.330800      -2.569100     -0.6764000    
 C   -2.579100       1.038800      0.2706000    
 C   -3.366100       2.070000     -0.5385000    
 C    2.000900      1.1000000E-02  0.6644000    
 C  -0.7222000      -3.787200      4.1000000E-03
 C    3.055200      0.4595000     -0.3462000    
 C    4.310700      0.9763000      0.3575000    
 C   -3.590000       3.346100      0.2588000    
 C    5.378700       1.391600     -0.6418000    
 H   -2.194800      -1.666100       1.072400    
 H   -3.178400     -0.6376000     -0.9183000    
 H   -1.642800      5.0799999E-02  -1.398900    
 H   0.1927000      -1.717200       1.537400    
 H  -0.4300000     -8.7200001E-02   1.635800    
 H  -0.7108000      -2.293600      -1.538000    
 H   -2.309400      -2.860300      -1.078800    
 H   -1.651700       1.507400      0.6189000    
 H   -3.153000      0.7628000       1.163600    
 H   0.4356000      0.2922000     -0.6058000    
 H   -4.334200       1.649500     -0.8340000    
 H   -2.822600       2.313300      -1.458700    
 H    1.752600      0.8506000       1.325300    
 H    2.417300     -0.7927000       1.283700    
 H  -0.7434000      -4.644800     -0.6764000    
 H   -1.282800      -4.056300      0.9047000    
 H   0.3221000      -3.615500      0.2802000    
 H    3.320800     -0.3801000      -1.001000    
 H    2.646500       1.251300     -0.9868000    
 H    4.056300       1.834100      0.9909000    
 H    4.717600      0.1977000       1.013300    
 H   -2.637300       3.808800      0.5356000    
 H   -4.158300       4.068700     -0.3351000    
 H   -4.152700       3.142000       1.175300    
 H    6.266300       1.758600     -0.1172000    
 H    5.679700      0.5461000      -1.268500    
 H    5.015000       2.191400      -1.294800    


%chk=000108563-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000108563

0 1
N 0.776313 -0.342193 0.074184
C -1.525304 -1.354892 0.258761
C -2.218183 -0.222638 -0.552316
C -0.251634 -0.866852 1.000415
C -1.231855 -2.571354 -0.661847
C -2.585948 1.043985 0.254366
C -3.387565 2.072436 -0.576760
C 2.070110 -0.009784 0.710187
C -0.862418 -3.866458 0.094078
C 3.074459 0.537793 -0.322514
C 4.444965 0.894290 0.296452
C -3.733546 3.351880 0.215230
C 5.445749 1.442519 -0.743772
H -2.238208 -1.682075 1.048677
H -3.146390 -0.639027 -0.995854
H -1.578826 0.059755 -1.416059
H 0.196250 -1.719869 1.546202
H -0.544693 -0.120963 1.781673
H -0.407293 -2.293815 -1.346535
H -2.126853 -2.764213 -1.288486
H -1.668911 1.534888 0.640616
H -3.179705 0.753859 1.146510
H 0.418844 0.459691 -0.464787
H -4.321156 1.597170 -0.941317
H -2.804786 2.342660 -1.481561
H 1.964446 0.729623 1.547066
H 2.476615 -0.937446 1.161795
H -0.724940 -4.709390 -0.608345
H -1.656294 -4.151122 0.811518
H 0.080709 -3.753724 0.659497
H 3.204440 -0.215683 -1.123802
H 2.647933 1.443100 -0.806223
H 4.301672 1.642439 1.102836
H 4.871501 -0.007744 0.780936
H -2.815867 3.862429 0.564188
H -4.305032 4.069357 -0.402114
H -4.343022 3.113664 1.107521
H 6.419183 1.686901 -0.280145
H 5.628468 0.702177 -1.545290
H 5.057270 2.362525 -1.220183


