%chk=000037845.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037845

0 1
 O   0.6994000      -1.086800     -0.2733000    
 O   -1.850000      -2.477600     -0.1604000    
 O    2.334000      -3.367200     -9.9299997E-02
 O   0.6237000       1.640200     -0.1716000    
 O   -4.225000       1.512900      0.1300000    
 O   -2.855500       3.748100      0.1214000    
 N    4.036300     -0.1263000      0.4532000    
 C    2.647300      -2.171500      0.6207000    
 C    3.610900      -1.340500     -0.2298000    
 C    1.346200      -1.441500      0.9466000    
 C    4.995000      0.6166000     -0.3535000    
 C  -0.4946000     -0.4352000     -0.1736000    
 C   -1.706100      -1.122900     -0.1212000    
 C   -2.950800     -0.5098000     -2.1000000E-02
 C  -0.5726000      0.9604000     -0.1198000    
 C   -1.805600       1.614600     -1.8700000E-02
 C   -3.010500      0.8950000      3.2299999E-02
 C   -3.900100      -1.565900      1.9000000E-03
 C   -3.181600      -2.735600     -8.5400000E-02
 C    6.234800     -0.2330000     -0.6178000    
 C    5.361700       1.914000      0.3602000    
 C   -1.828400       3.089300      3.4600001E-02
 C   -3.570000      -4.152700     -0.1106000    
 C  -0.5184000       3.764000     -2.4499999E-02
 C   0.5798000       3.011300     -0.1206000    
 H    3.130700      -2.472600       1.557900    
 H    3.145300      -1.101100      -1.194300    
 H    4.455900      -1.999800     -0.4548000    
 H    1.536200     -0.5459000       1.549000    
 H   0.6859000      -2.111600       1.510700    
 H    4.538300      0.8908000      -1.312900    
 H    4.447600     -0.3658000       1.355000    
 H   -4.975500      -1.481400      7.2999999E-02
 H    7.039200      0.3890000      -1.028100    
 H    6.620300     -0.6934000      0.2992000    
 H    6.055200      -1.019000      -1.357800    
 H    4.471100       2.525000      0.5452000    
 H    6.050900       2.509800     -0.2480000    
 H    5.846000       1.720700       1.324100    
 H    3.164900      -3.853000     -0.2384000    
 H   -3.120700      -4.689500      0.7307000    
 H   -4.656500      -4.266100     -4.3600000E-02
 H   -3.236400      -4.626300      -1.039000    
 H  -0.4765000       4.845200      1.1000000E-02
 H    1.578000       3.424200     -0.1689000    
 H   -4.117400       2.475600      0.1575000    


%chk=000037845-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000037845

0 1
O 0.965739 -1.182593 -0.927881
O -1.573759 -2.321925 0.389218
O 2.683904 -3.466159 -1.684292
O 0.910433 1.470438 -1.489199
O -3.709867 1.894177 0.152778
O -2.453896 3.880303 -0.856418
N 3.965402 -0.866268 0.750841
C 2.792789 -2.714039 -0.423408
C 3.764441 -1.516101 -0.556076
C 1.382154 -2.290715 -0.027402
C 4.217080 0.598808 0.750838
C -0.181714 -0.475005 -0.589676
C -1.365442 -0.987401 -0.005527
C -2.542049 -0.227839 0.259402
C -0.250935 0.902373 -0.910433
C -1.412451 1.714413 -0.681040
C -2.581572 1.142481 -0.079828
C -3.504742 -1.142146 0.844092
C -2.911435 -2.384032 0.913299
C 5.545528 1.006492 0.055022
C 4.170373 1.111952 2.204339
C -1.410793 3.129547 -1.057101
C -3.344477 -3.727566 1.393727
C -0.185694 3.637360 -1.661325
C 0.890998 2.807833 -1.843991
H 3.160856 -3.389704 0.383976
H 3.310409 -0.787867 -1.249834
H 4.711780 -1.881702 -1.027709
H 1.394731 -1.920404 1.013924
H 0.685159 -3.138809 -0.133989
H 3.375097 1.053271 0.190677
H 4.633610 -1.367290 1.352301
H -4.512249 -0.889921 1.164587
H 5.650549 2.107023 0.009676
H 6.415019 0.604788 0.611261
H 5.589711 0.618718 -0.979562
H 3.203673 0.857004 2.671596
H 4.305307 2.207939 2.241472
H 4.978223 0.654441 2.809578
H 3.588141 -3.566940 -2.077600
H -2.696475 -4.091271 2.212568
H -4.379803 -3.676484 1.767196
H -3.303873 -4.476095 0.581081
H -0.135000 4.684930 -1.964744
H 1.844892 3.103482 -2.285603
H -3.497373 2.855206 -0.183511


