%chk=000132898.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132898

0 1
 O   0.5439000     -0.1113000       2.495100    
 O   -1.314000       3.281500     -0.3746000    
 O   -4.035400       3.205700      0.1714000    
 O    3.796400     -0.4508000      -1.945200    
 O    4.438000       1.277200      0.1355000    
 N   -2.014100      -2.782500      -1.029100    
 C   -1.159900      -1.612900     -0.7480000    
 C   -1.936400     -0.3310000     -0.5100000    
 C  -0.2070000      -1.918400      0.4140000    
 C   -3.313600     -0.3656000     -0.2241000    
 C   -4.061500      -1.673300     -0.2217000    
 C   -3.132300      -2.878400     -8.9299999E-02
 C    1.026300      -1.064400      0.3494000    
 C   -1.278100      0.9078000     -0.5562000    
 C   -4.008400      0.8318000     -3.3000000E-03
 C   -1.976700       2.092700     -0.3251000    
 C   -3.340600       2.054700     -4.8700001E-02
 C    1.341000     -0.2017000       1.393700    
 C    1.846700      -1.149700     -0.7703000    
 C    2.995900     -0.3626000     -0.8464000    
 C    2.490100      0.5855000       1.317500    
 C    3.317600      0.5051000      0.1974000    
 C   0.8348000     -0.9910000       3.579100    
 C    3.508500      0.4304000      -3.029100    
 C    5.638700      0.7212000      0.6679000    
 H  -0.6061000      -1.466700      -1.682900    
 H   0.1380000      -2.961200      0.3698000    
 H  -0.7329000      -1.824000       1.370500    
 H   -4.783000      -1.690200      0.6037000    
 H   -4.624800      -1.745300      -1.160700    
 H   -2.765000      -2.972100      0.9398000    
 H   -3.701200      -3.790700     -0.3013000    
 H   -1.459900      -3.637100     -0.9959000    
 H  -0.2270000      0.9656000     -0.8195000    
 H   -5.076400      0.8014000      0.2007000    
 H    1.619300      -1.836500      -1.581300    
 H    2.740100       1.262800       2.130400    
 H  -0.3762000       3.115100     -0.5716000    
 H   -4.966700       2.985900      0.3457000    
 H   0.8642000      -2.033700       3.247000    
 H   4.4799998E-02 -0.8847000       4.327700    
 H    1.790500     -0.7194000       4.038200    
 H    3.601300       1.473900      -2.712300    
 H    2.502300      0.2437000      -3.417900    
 H    4.232500      0.2410000      -3.826200    
 H    6.441400       1.452300      0.5388000    
 H    5.909900     -0.1943000      0.1329000    
 H    5.523600      0.5125000       1.736200    


%chk=000132898-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000132898

0 1
O 0.199871 -0.742706 2.232577
O -0.980232 3.080840 -0.155320
O -3.480782 3.152990 0.927332
O 3.997039 -0.482549 -1.945059
O 4.278601 1.266570 0.396153
N -2.375619 -2.870581 -1.240253
C -1.327341 -1.849180 -1.023302
C -1.958983 -0.541797 -0.543002
C -0.194003 -2.379088 -0.039462
C -3.270013 -0.502207 -0.001450
C -4.155694 -1.741734 0.011314
C -3.324431 -3.031142 -0.116280
C 1.007731 -1.466833 0.094993
C -1.215210 0.661865 -0.621562
C -3.775709 0.730623 0.482120
C -1.713150 1.880765 -0.122757
C -3.016727 1.917888 0.440659
C 1.172989 -0.615262 1.229215
C 1.971131 -1.381401 -0.935180
C 3.062377 -0.487778 -0.877083
C 2.268015 0.276662 1.312801
C 3.218387 0.336455 0.269306
C 0.245322 0.202902 3.349757
C 4.032747 0.783105 -2.712273
C 5.628079 0.654791 0.447989
H -0.838112 -1.663852 -2.001026
H 0.134824 -3.355808 -0.449105
H -0.643606 -2.555385 0.951686
H -4.766883 -1.774261 0.934406
H -4.855828 -1.692556 -0.846410
H -2.822012 -3.243141 0.858246
H -3.985401 -3.888099 -0.339554
H -1.979106 -3.764319 -1.556783
H -0.213772 0.646314 -1.070427
H -4.792368 0.762704 0.900305
H 1.880664 -2.017329 -1.823469
H 2.423669 0.929873 2.175481
H -0.075029 2.908996 -0.517904
H -4.407779 3.055824 1.260251
H 1.170358 0.078111 3.946527
H -0.630349 -0.041918 3.968536
H 0.168374 1.247418 2.991788
H 4.275530 1.637588 -2.054138
H 3.058403 0.956609 -3.209045
H 4.818530 0.646946 -3.471224
H 6.331656 1.500163 0.492095
H 5.815430 0.037220 -0.448566
H 5.727011 0.034003 1.358798


