%chk=000030211.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030211

0 1
 O    7.833900     -9.8999999E-02  0.3700000    
 N    7.299300      -1.260000      -1.539500    
 C   -4.758400      -1.013400      0.3868000    
 C   -6.201800     -0.4968000      0.1371000    
 C   -6.326500      0.9973000      0.3753000    
 C   -3.701500     -7.6800004E-02 -0.2449000    
 C   -5.402000       1.754100     -0.5665000    
 C   -4.012000       1.164400     -0.6964000    
 C   -4.706200      -2.439500     -0.2141000    
 C   -4.516600      -1.113300       1.910500    
 C   -2.348000     -0.6041000     -0.3003000    
 C   -3.058700       2.122000      -1.373500    
 C   -1.259800      0.1354000     -3.1500001E-02
 C   0.1291000     -0.3238000     -6.5399997E-02
 C   0.3754000      -1.768400     -0.4364000    
 C    1.193500      0.4596000      0.2138000    
 C    2.600200      0.1058000      0.2093000    
 C    3.569700      0.9869000      0.5086000    
 C    4.998400      0.6860000      0.5371000    
 C    5.728900       1.365700       1.663300    
 C    5.559600     -0.1090000     -0.3944000    
 C    7.003300     -0.4730000     -0.4491000    
 H   -6.916000      -1.028300      0.7789000    
 H   -6.502800     -0.7106000     -0.8982000    
 H   -6.086800       1.242600       1.416200    
 H   -7.361300       1.318600      0.2097000    
 H   -5.332300       2.790800     -0.2141000    
 H   -5.854800       1.787000      -1.565900    
 H   -5.562400      -3.036400      0.1227000    
 H   -4.732500      -2.412100      -1.309600    
 H   -3.808900      -2.987900      9.2399999E-02
 H   -5.294500      -1.713800       2.395800    
 H   -3.554700      -1.589700       2.133300    
 H   -4.508500     -0.1275000       2.387900    
 H   -2.241500      -1.635800     -0.6139000    
 H   -3.586700       2.683300      -2.154100    
 H   -2.235000       1.626100      -1.893000    
 H   -2.665700       2.848600     -0.6556000    
 H   -1.369200       1.160300      0.3158000    
 H  -0.1410000      -2.429100      0.2704000    
 H  -1.5900001E-02  -1.967900      -1.441200    
 H    1.412000      -2.101200     -0.4498000    
 H   0.9915000       1.498500      0.4778000    
 H    2.889700     -0.9109000     -2.2600001E-02
 H    3.304200       2.011200      0.7651000    
 H    6.424800       2.115300       1.272200    
 H    5.049700       1.879600       2.353300    
 H    6.284100      0.6371000       2.263400    
 H    4.943900     -0.5306000      -1.186400    
 H    8.248900      -1.577200      -1.705400    
 H    6.602500      -1.556100      -2.215800    


%chk=000030211-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000030211

0 1
O 8.050168 0.013811 0.308810
N 7.367485 -1.746847 -1.025103
C -4.795606 -1.055913 0.308821
C -6.251110 -0.521215 0.163764
C -6.389634 0.946667 0.599459
C -3.751987 -0.012751 -0.193875
C -5.522433 1.822055 -0.320759
C -4.113127 1.280955 -0.529181
C -4.711704 -2.373557 -0.521300
C -4.504176 -1.392989 1.802119
C -2.371878 -0.520349 -0.296325
C -3.186000 2.291600 -1.183837
C -1.200788 0.167350 -0.048063
C 0.146569 -0.380521 -0.159656
C 0.317793 -1.816929 -0.621350
C 1.221401 0.446700 0.163081
C 2.625444 0.125074 0.117524
C 3.619417 1.016431 0.482905
C 5.072647 0.801299 0.472139
C 5.879183 1.855519 1.213127
C 5.648325 -0.271722 -0.184252
C 7.091174 -0.613480 -0.253528
H -6.925834 -1.174675 0.750883
H -6.563502 -0.606947 -0.897782
H -6.062359 1.065768 1.650494
H -7.446656 1.270766 0.553291
H -5.446167 2.854730 0.079412
H -6.014741 1.928586 -1.312927
H -5.577280 -3.017072 -0.274520
H -4.739548 -2.165217 -1.606822
H -3.801557 -2.960399 -0.301950
H -5.173801 -2.201298 2.153860
H -3.459431 -1.727976 1.936122
H -4.654946 -0.511537 2.451311
H -2.277092 -1.585074 -0.547951
H -3.750652 2.883282 -1.931136
H -2.327159 1.819368 -1.687586
H -2.786996 3.020562 -0.449002
H -1.261538 1.209238 0.293925
H -0.203581 -2.513447 0.062938
H -0.118933 -1.963870 -1.627330
H 1.373736 -2.123945 -0.664773
H 0.978852 1.469825 0.491436
H 2.913902 -0.882994 -0.208591
H 3.297767 2.000741 0.857590
H 6.956704 1.646638 1.164942
H 5.677214 2.854592 0.778876
H 5.564291 1.898277 2.273875
H 4.984130 -0.951525 -0.736753
H 8.340930 -2.034987 -1.113224
H 6.643686 -2.278600 -1.504030


