%chk=000034029.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034029

0 1
 O    1.285800      9.2299998E-02 -0.3682000    
 O   0.1240000     -7.1699999E-02   1.624700    
 N    4.952400      0.1703000      2.0099999E-02
 C   -1.083100      4.0800001E-02 -0.4292000    
 C   -1.902600       1.271600     -0.1035000    
 C   -1.843000      -1.260000     -0.2767000    
 C   -4.027400     -1.6799999E-02 -0.5965000    
 C   -3.306000       1.241600     -0.1834000    
 C   -3.246400      -1.284900     -0.3564000    
 C   0.1690000      1.2800000E-02  0.4058000    
 C   -1.258400       2.467300      0.2515000    
 C   -1.142900      -2.461600     -8.5699998E-02
 C   -4.038800       2.408200      7.8599997E-02
 C   -3.923400      -2.509300     -0.2584000    
 C    3.666200      0.1687000     -0.6608000    
 C    2.527900      7.3100001E-02  0.3425000    
 C   -1.998300       3.617700      0.5232000    
 C   -1.827600      -3.671500      2.4400000E-02
 C   -3.387400       3.588600      0.4352000    
 C   -3.216700      -3.695400     -6.3500002E-02
 C    6.048400      0.3046000     -0.9427000    
 C    5.121600      -1.051100      0.8110000    
 C    5.872300       1.569400      -1.761100    
 C    6.434400      -1.004700       1.569000    
 H  -0.8009000      0.1199000      -1.488700    
 H   -4.968500     -7.7500001E-02 -3.5000000E-02
 H   -4.268300      5.0600000E-02  -1.664400    
 H  -0.1752000       2.537000      0.3007000    
 H  -5.7399999E-02  -2.486900     -4.2900000E-02
 H   -5.123500       2.402600      5.5000000E-03
 H   -5.007400      -2.544100     -0.3338000    
 H    3.587300     -0.6485000      -1.390400    
 H    3.490900       1.095500      -1.217800    
 H    2.556800      0.9162000       1.043500    
 H    2.540100     -0.8679000      0.8983000    
 H   -1.490300       4.538900      0.7930000    
 H   -1.276400      -4.596200      0.1682000    
 H   -3.963700       4.486200      0.6393000    
 H   -3.749900      -4.638300      1.4600000E-02
 H    7.008900      0.4141000     -0.4295000    
 H    6.120800     -0.5635000      -1.609700    
 H    4.359600      -1.133600       1.590200    
 H    5.072000      -1.956400      0.1935000    
 H    5.103400       1.468200      -2.533500    
 H    5.640900       2.437100      -1.133700    
 H    6.806800       1.794100      -2.288600    
 H    7.298900      -1.196500      0.9258000    
 H    6.577100     -4.8700001E-02   2.084800    
 H    6.442500      -1.789000       2.335000    


%chk=000034029-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000034029

0 1
O 1.324959 0.043772 -0.319975
O 0.367314 0.128802 1.798634
N 5.069974 -0.075346 -0.283954
C -1.067821 -0.008935 -0.229993
C -1.941477 1.248936 -0.075637
C -1.897913 -1.267626 0.077907
C -3.678857 -0.119018 -1.298519
C -3.242799 1.185261 -0.644127
C -3.199241 -1.318905 -0.492355
C 0.236378 0.062942 0.556264
C -1.510275 2.436085 0.557303
C -1.428583 -2.352894 0.851049
C -4.091348 2.312524 -0.574488
C -4.008843 -2.457806 -0.284444
C 3.694901 -0.026025 -0.838236
C 2.682876 0.107495 0.305609
C -2.361597 3.563287 0.615744
C -2.240906 -3.493109 1.047812
C -3.653610 3.504218 0.047195
C -3.532486 -3.548710 0.477905
C 6.069410 0.661210 -1.101837
C 5.495679 -1.456102 0.075002
C 5.945357 2.190041 -0.960617
C 6.553606 -1.490981 1.194295
H -0.773867 -0.069121 -1.299714
H -4.774630 -0.146228 -1.431422
H -3.238886 -0.172862 -2.319977
H -0.520385 2.483417 1.022817
H -0.440058 -2.307721 1.319321
H -5.098580 2.256894 -1.004976
H -5.016107 -2.489562 -0.717171
H 3.447666 -0.925021 -1.449659
H 3.594324 0.848606 -1.504437
H 2.795936 1.069184 0.834570
H 2.772094 -0.708165 1.045671
H -2.019927 4.478795 1.111155
H -1.869900 -4.328594 1.651728
H -4.318047 4.374049 0.096291
H -4.166921 -4.428228 0.634145
H 7.073735 0.357058 -0.755837
H 6.006323 0.373197 -2.181866
H 4.599485 -2.004227 0.422247
H 5.873040 -2.009908 -0.821814
H 4.959626 2.557029 -1.300800
H 6.071279 2.484129 0.095824
H 6.717893 2.699037 -1.566812
H 7.486031 -0.976670 0.898796
H 6.165006 -0.994797 2.100453
H 6.814670 -2.536102 1.445229


