%chk=000097005.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097005

0 1
 O   -4.872200      0.4611000      0.7685000    
 O    3.883500      -1.232600      0.1745000    
 O    4.034800      0.9544000      5.7700001E-02
 N   -2.185000      0.3637000     -0.2074000    
 N  -3.2699998E-02   1.384400     -0.1617000    
 N    3.350600     -9.8600000E-02  8.4899999E-02
 C   -3.047700     -0.7723000     -0.1846000    
 C  -0.7742000      0.2543000     -0.1332000    
 C   -4.504200     -0.3693000     -0.3252000    
 C  -0.2412000      -1.020900     -3.5399999E-02
 C    1.141900      -1.144200      3.8199998E-02
 C    1.938300     -4.8000002E-03  1.1900000E-02
 C    1.307800       1.225000     -8.8100001E-02
 H   -2.928800      -1.310900      0.7637000    
 H   -2.812400      -1.455300      -1.009400    
 H   -2.564000       1.301100     -0.2748000    
 H   -5.157200      -1.247600     -0.3317000    
 H   -4.672400      0.1939000      -1.248700    
 H  -0.8314000      -1.929200     -1.0200000E-02
 H    1.567400      -2.141400      0.1157000    
 H    1.857500       2.161100     -0.1148000    
 H   -4.743000     -5.2700002E-02   1.583900    


%chk=000097005-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000097005

0 1
O -4.870208 0.828170 0.442062
O 4.042918 -1.126766 -0.081018
O 4.035653 1.158502 0.040282
N -2.165756 0.210428 -0.042080
N -0.104346 1.273473 0.045206
N 3.428073 0.014821 -0.021107
C -3.132034 -0.887544 -0.044634
C -0.800710 0.079348 -0.027630
C -4.524784 -0.330142 -0.396740
C -0.136503 -1.192391 -0.086561
C 1.261702 -1.219124 -0.086812
C 1.967918 0.008734 -0.023496
C 1.245170 1.227497 0.045335
H -3.160313 -1.396763 0.944903
H -2.852061 -1.648387 -0.799751
H -2.537770 1.156736 0.097816
H -5.282969 -1.134859 -0.323120
H -4.525337 0.070450 -1.423314
H -0.704984 -2.125098 -0.123667
H 1.821586 -2.157144 -0.130674
H 1.780708 2.179623 0.103552
H -5.070551 0.529635 1.365250


