%chk=000170907.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000170907

0 1
 O   -1.939900     -0.1977000      0.4290000    
 O   -2.072800       1.526800      -1.135000    
 N   -8.605500     -0.9915000     -0.1969000    
 C    6.492700      9.6000001E-02  0.1872000    
 C    4.978300     -4.3200001E-02  2.1299999E-02
 C    7.210400      -1.215500     -0.1359000    
 C    4.259000       1.259700      0.3773000    
 C    8.720600      -1.086500      6.1999999E-02
 C    2.768800       1.144000      0.1832000    
 C    9.433700      -2.398000     -0.2255000    
 C    2.214900       1.468600      -1.046300    
 C    1.975100      0.7142000       1.236200    
 C   0.8359000       1.360900      -1.226800    
 C   0.5961000      0.6064000       1.055700    
 C   2.6600000E-02  0.9298000     -0.1758000    
 C   -1.411500      0.8190000     -0.3630000    
 C   -3.321700     -0.3621000      0.3002000    
 C   -3.797100      -1.230400     -0.6570000    
 C   -4.153700      0.3503000       1.134800    
 C   -5.176300      -1.394900     -0.7865000    
 C   -5.532800      0.1858000       1.005600    
 C   -6.044000     -0.6868000      4.4799998E-02
 C   -7.456700     -0.8548000     -8.8500001E-02
 H    6.864300      0.8909000     -0.4708000    
 H    6.721800      0.3949000       1.217300    
 H    4.611000     -0.8564000      0.6602000    
 H    4.749300     -0.3271000      -1.013700    
 H    6.997700      -1.506600      -1.171700    
 H    6.823600      -2.013500      0.5098000    
 H    4.474300       1.537600       1.417100    
 H    4.645000       2.083800     -0.2367000    
 H    9.117300     -0.3072000     -0.5990000    
 H    8.936900     -0.7796000       1.092000    
 H    10.51220      -2.282900     -7.9300001E-02
 H    9.082900      -3.190400      0.4433000    
 H    9.263200      -2.718900      -1.258100    
 H    2.837200       1.802700      -1.871700    
 H    2.409400      0.4610000       2.199200    
 H   0.4086000       1.613800      -2.193700    
 H  -1.0100000E-02  0.2802000       1.896700    
 H   -3.121500      -1.781700      -1.303400    
 H   -3.755400       1.028800       1.882600    
 H   -5.559400      -2.078700      -1.540200    
 H   -6.196400      0.7449000       1.660900    


%chk=000170907-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000170907

0 1
O -2.149144 0.107238 0.248809
O -1.834508 1.813023 -1.351815
N -8.854859 -1.334125 -0.089912
C 6.583344 -0.129169 0.464098
C 5.082769 -0.061015 0.104649
C 7.381298 -1.088032 -0.448171
C 4.288561 0.908277 1.028177
C 8.881915 -1.167010 -0.084727
C 2.812671 0.959069 0.676376
C 9.672930 -2.125802 -1.000579
C 2.329161 1.856825 -0.314050
C 1.885694 0.076974 1.293944
C 0.970964 1.872606 -0.677871
C 0.523391 0.083538 0.938971
C 0.054110 0.983811 -0.054170
C -1.365858 1.048275 -0.479071
C -3.542133 -0.096262 0.084680
C -4.068601 -1.065812 0.972924
C -4.375989 0.562249 -0.854198
C -5.434491 -1.386556 0.931238
C -5.745539 0.232725 -0.888340
C -6.289637 -0.737475 -0.004121
C -7.690277 -1.062526 -0.051619
H 7.023781 0.888170 0.402182
H 6.693740 -0.451455 1.520856
H 4.635937 -1.073458 0.171654
H 4.964463 0.262541 -0.949141
H 7.277895 -0.763085 -1.504541
H 6.937850 -2.104164 -0.391544
H 4.418725 0.580954 2.078094
H 4.736064 1.918104 0.946204
H 9.324261 -0.151274 -0.140200
H 8.984366 -1.492910 0.970608
H 10.741517 -2.164821 -0.720030
H 9.269833 -3.154431 -0.940122
H 9.612644 -1.804553 -2.057613
H 3.027726 2.550110 -0.797465
H 2.240320 -0.618200 2.064321
H 0.595544 2.565100 -1.438530
H -0.182444 -0.596663 1.422364
H -3.394812 -1.552811 1.683308
H -3.964009 1.309202 -1.531985
H -5.846262 -2.134600 1.615152
H -6.400909 0.733115 -1.607894


