%chk=000037070.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037070

0 1
 O    1.528500      0.2770000      0.1796000    
 O   -1.980800     -0.3815000      9.4899997E-02
 O   0.3471000      -1.701800      0.3107000    
 O   -4.377200      -1.801800      8.7300003E-02
 N    5.187300     -0.1346000      0.3522000    
 C    3.903500      0.5558000      0.2333000    
 C    5.569400     -0.7276000     -0.9289000    
 C    6.222400      0.7876000      0.8176000    
 C    2.753400     -0.4374000      0.2809000    
 C    6.871400      -1.501300     -0.8091000    
 C    6.441100       1.914800     -0.1774000    
 C   0.3896000     -0.4834000      0.2076000    
 C  -0.8131000      0.4154000      9.0499997E-02
 C   -3.184400      0.2714000     -1.9099999E-02
 C   -4.381800     -0.4442000     -2.3100000E-02
 C   -3.202500       1.661700     -0.1317000    
 C   -5.597100      0.2306000     -0.1397000    
 C   -4.417800       2.336300     -0.2483000    
 C   -5.615000       1.620800     -0.2523000    
 C   -5.643800      -2.457500      7.4800000E-02
 H    3.755200       1.254000       1.068700    
 H    3.823400       1.160800     -0.6792000    
 H    4.812700      -1.463000      -1.225400    
 H    5.621800     -1.1500000E-02  -1.756600    
 H    5.920000       1.214700       1.782700    
 H    7.165200      0.2741000       1.033600    
 H    2.771700     -0.9912000       1.227800    
 H    2.804500      -1.150600     -0.5482000    
 H    7.012200      -2.121700      -1.701600    
 H    6.865200      -2.174000      5.5599999E-02
 H    7.745400     -0.8466000     -0.7421000    
 H    7.163000       2.620700      0.2514000    
 H    5.539900       2.497700     -0.3863000    
 H    6.877600       1.580600      -1.122600    
 H  -0.7977000       1.085700      0.9579000    
 H  -0.7151000      0.9536000     -0.8598000    
 H   -2.312600       2.281500     -0.1344000    
 H   -6.564900     -0.2587000     -0.1500000    
 H   -4.433100       3.418900     -0.3356000    
 H   -6.560700       2.147300     -0.3431000    
 H   -5.451700      -3.531200      0.1714000    
 H   -6.164100      -2.312300     -0.8780000    
 H   -6.257700      -2.166100      0.9340000    


%chk=000037070-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000037070

0 1
O 1.489171 0.390883 0.275812
O -2.057379 -0.266835 0.133600
O 0.329554 -1.580288 0.764386
O -4.208853 -1.782459 -0.093379
N 5.213761 -0.013470 0.168901
C 3.894321 0.648639 0.040012
C 5.570881 -0.835051 -1.016264
C 6.291993 0.864946 0.687366
C 2.790120 -0.313559 0.498641
C 6.702525 -1.842287 -0.739827
C 6.766511 2.002898 -0.257921
C 0.332176 -0.373795 0.466098
C -0.866152 0.552708 0.277667
C -3.276444 0.422201 0.014374
C -4.440580 -0.404248 -0.105783
C -3.412829 1.827422 0.006441
C -5.711100 0.201746 -0.225722
C -4.692846 2.423000 -0.115240
C -5.837107 1.612808 -0.230104
C -5.376310 -2.659152 -0.200378
H 3.870781 1.546964 0.683408
H 3.675490 0.990581 -0.998239
H 4.665539 -1.398728 -1.310573
H 5.842248 -0.201388 -1.897902
H 5.930433 1.305828 1.635971
H 7.155530 0.228752 0.954932
H 2.889367 -0.556450 1.570597
H 2.784615 -1.257439 -0.074515
H 6.849844 -2.498158 -1.617356
H 6.448596 -2.471456 0.131338
H 7.665827 -1.341105 -0.535362
H 7.543134 2.612063 0.241057
H 5.932180 2.675818 -0.529950
H 7.202310 1.603482 -1.191654
H -0.937297 1.215543 1.166399
H -0.693805 1.189503 -0.612660
H -2.532004 2.470862 0.091768
H -6.607688 -0.418687 -0.315697
H -4.782092 3.514227 -0.119475
H -6.829565 2.065929 -0.324223
H -4.966685 -3.678915 -0.164182
H -5.912269 -2.504187 -1.157590
H -6.075504 -2.506143 0.645228


