%chk=000119052.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000119052

0 1
 O    1.168200      -3.005800      -1.130900    
 O  -0.7880000     -0.7885000      0.3513000    
 O   0.5935000       1.799200      0.7160000    
 O   6.2899999E-02  -2.512000       1.633800    
 O    3.437100      0.8246000      -1.261300    
 O   0.9540000       1.725000      -1.558600    
 N   -3.714600      0.4136000      0.1314000    
 C   -2.514400      0.8197000      0.9273000    
 C    1.205300      -1.815400     -0.3206000    
 C   -1.812700     -0.4880000       1.314800    
 C   0.8993000      -1.774800      -1.806000    
 C   -2.936700      -1.512300       1.224400    
 C   -3.698700      -1.046500     -4.1999999E-03
 C   -1.776600       1.812200      8.3099999E-02
 C    2.603200      -1.483500      0.1461000    
 C   -3.629600       1.119600      -1.161600    
 C   9.4099998E-02  -1.773300      0.6601000    
 C   -2.413100       1.978300      -1.081000    
 C  -0.3858000      -1.671700      -2.531300    
 C    2.752900     -0.1306000      0.8285000    
 C  -0.5959000       2.593500      0.5516000    
 C    2.759200       1.124200     -3.8500000E-02
 C    1.337000       1.556200     -0.4066000    
 C    3.483700       2.338200      0.5676000    
 C    2.915400     -0.1019000       2.164400    
 H   -2.892000       1.310900       1.833200    
 H   -1.375600     -0.4282000       2.318100    
 H    1.688500      -1.378500      -2.439800    
 H   -3.575700      -1.458000       2.114000    
 H   -2.586000      -2.540800       1.102100    
 H   -3.170700      -1.380800     -0.9050000    
 H   -4.714100      -1.453000     -3.0999999E-02
 H    3.319500      -1.556600     -0.6817000    
 H    2.910500      -2.280600      0.8379000    
 H   -4.520000       1.743600      -1.290300    
 H   -3.558100      0.4478000      -2.024100    
 H   -2.114800       2.668900      -1.856700    
 H  -0.7010000     -0.6265000      -2.602600    
 H   -1.178200      -2.237500      -2.032600    
 H  -0.2830000      -2.066600      -3.546900    
 H  -0.3779000       3.435300     -0.1179000    
 H  -0.8203000       3.034000       1.529400    
 H    3.517300       3.168200     -0.1492000    
 H    2.994200       2.716100       1.471300    
 H    4.525300       2.093700      0.8063000    
 H    3.034800      0.8218000       2.717600    
 H    2.919300      -1.015300       2.751000    
 H    3.476400       1.634500      -1.798000    


%chk=000119052-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000119052

0 1
O 1.206950 -3.036993 -1.343438
O -0.798680 -0.771608 0.295367
O 0.609086 1.947436 0.762841
O 0.138861 -2.435593 1.634079
O 3.384065 0.708797 -1.295771
O 1.045408 1.978702 -1.526144
N -3.687842 0.345295 0.076837
C -2.543781 0.821760 0.932787
C 1.246055 -1.808786 -0.459586
C -1.796876 -0.466070 1.368421
C 1.012387 -1.642092 -1.933841
C -2.921741 -1.520610 1.383455
C -3.794082 -1.138162 0.160509
C -1.813909 1.828516 0.052466
C 2.622136 -1.525097 0.160399
C -3.586918 0.957789 -1.277234
C 0.145586 -1.753829 0.585112
C -2.406306 1.900521 -1.168380
C -0.311433 -1.366864 -2.608526
C 2.713802 -0.177474 0.870656
C -0.689917 2.700612 0.521298
C 2.774742 1.085063 -0.012894
C 1.369352 1.677979 -0.346680
C 3.609412 2.234762 0.613164
C 2.745084 -0.110744 2.226185
H -2.911557 1.308847 1.863701
H -1.252373 -0.382315 2.324133
H 1.900306 -1.308462 -2.489820
H -3.495890 -1.407665 2.321795
H -2.530840 -2.548551 1.343308
H -3.395069 -1.619200 -0.762614
H -4.841466 -1.467962 0.285894
H 3.372774 -1.577711 -0.645699
H 2.823088 -2.328802 0.890767
H -4.515096 1.494285 -1.564247
H -3.408219 0.185476 -2.063769
H -2.082173 2.550786 -1.986304
H -0.474120 -0.275781 -2.677114
H -1.149634 -1.808268 -2.047031
H -0.304928 -1.788492 -3.629921
H -0.477697 3.498960 -0.209768
H -0.881232 3.129384 1.519583
H 3.653043 3.088133 -0.086795
H 3.182072 2.584725 1.567110
H 4.634919 1.869133 0.783301
H 2.816039 0.832638 2.775677
H 2.685575 -1.023666 2.829086
H 2.899136 1.213601 -2.007458


