%chk=000097072.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097072

0 1
 O    2.614900     -0.3920000       1.213300    
 O   -2.020800      -2.426900     -5.5000000E-03
 O    2.820900     -0.4101000      -1.064300    
 N  -3.4400001E-02  -1.327200     -2.7000001E-02
 N   -2.081800     -0.1462000      4.4000000E-03
 N   -2.146900       2.156400      1.5100000E-02
 C   9.4999999E-02   1.033200     -1.9600000E-02
 C   0.6934000     -0.1679000     -3.2000002E-02
 C   -1.419600      0.9848000      3.9999999E-04
 C   0.7454000       2.383900     -2.4000000E-02
 C   -1.418100      -1.352700     -9.1000004E-03
 C    2.152000     -0.3355000     -5.1800001E-02
 H    1.837500       2.315700     -4.1099999E-02
 H   0.4697000       2.946800      0.8737000    
 H   0.4425000       2.954200     -0.9082000    
 H   0.4674000      -2.210600     -3.6899999E-02
 H   -1.714200       3.073100      1.4000000E-02
 H   -3.161000       2.131900      2.8800000E-02
 H    3.589000     -0.5034000       1.245200    


%chk=000097072-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000097072

0 1
O 2.600830 -1.504117 0.380765
O -1.935659 -2.489957 0.320115
O 3.068151 0.756895 0.146442
N 0.029465 -1.243840 0.255866
N -2.095680 -0.148720 0.061639
N -2.191033 2.146855 -0.190534
C 0.040859 1.151814 -0.004449
C 0.729810 -0.049842 0.151249
C -1.424462 1.012604 -0.040588
C 0.666948 2.521183 -0.134070
C -1.403886 -1.353279 0.216139
C 2.220084 -0.160741 0.217895
H 1.762656 2.474743 -0.087227
H 0.319471 3.190840 0.678191
H 0.386919 2.990303 -1.098579
H 0.554188 -2.116030 0.370190
H -1.786619 3.073975 -0.279502
H -3.202457 2.024585 -0.212266
H 3.591313 -1.569772 0.424125


