%chk=000104777.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104777

0 1
 O   -4.091900      -1.289800     -0.8331000    
 N   -3.650800     -0.9456000      0.2708000    
 C  -0.1863000      0.3683000      5.8899999E-02
 C    1.154100     -8.8900000E-02  1.1400000E-02
 C   -1.248000     -0.5625000      0.1421000    
 C  -0.4619000       1.755100      2.3200000E-02
 C    1.429800      -1.475600      4.7100000E-02
 C    2.215900      0.8419000     -7.1800001E-02
 C  -0.9557000      -1.932600      0.1764000    
 C   0.3651000      -2.383000      0.1296000    
 C   0.6028000       2.662500     -5.9300002E-02
 C    1.923600       2.212100     -0.1062000    
 C   -2.569300     -9.4300002E-02  0.1884000    
 C   -1.793900       2.191600      7.1199998E-02
 C    2.761700      -1.912200     -7.9999998E-04
 C    3.537100      0.3737000     -0.1182000    
 C   -2.838800       1.272800      0.1531000    
 C    3.806700     -0.9934000     -8.2800001E-02
 H   -1.736800      -2.686700      0.2416000    
 H   0.5533000      -3.454400      0.1587000    
 H   0.4150000       3.733900     -8.8100001E-02
 H    2.723900       2.946600     -0.1700000    
 H   -2.029700       3.253500      4.5100000E-02
 H    2.997900      -2.973900      2.5400000E-02
 H    4.369800       1.071000     -0.1823000    
 H   -3.860300       1.646500      0.1890000    
 H    4.834300      -1.343800     -0.1193000    


%chk=000104777-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000104777

0 1
O -4.839796 -0.695552 0.093038
N -3.629880 -1.154940 0.085002
C -0.169509 0.337942 0.003117
C 1.196827 -0.104113 -0.003297
C -1.240787 -0.627996 0.040545
C -0.469468 1.749090 -0.027532
C 1.499046 -1.512611 0.027689
C 2.269248 0.859134 -0.040791
C -0.915718 -2.035946 0.070615
C 0.404285 -2.455989 0.064563
C 0.620021 2.693506 -0.064956
C 1.939115 2.265394 -0.071415
C -2.594889 -0.146797 0.046511
C -1.833521 2.178482 -0.020458
C 2.858387 -1.929203 0.020720
C 3.615728 0.399747 -0.046673
C -2.876034 1.250151 0.016423
C 3.903842 -0.980934 -0.016220
H -1.742131 -2.750389 0.097691
H 0.640254 -3.526388 0.088070
H 0.384115 3.763371 -0.088632
H 2.757736 2.994056 -0.100074
H -2.047708 3.253208 -0.045153
H 3.089354 -3.000492 0.044423
H 4.431304 1.131558 -0.075231
H -3.927252 1.558452 0.023338
H 4.945031 -1.319942 -0.021214


