%chk=000097297.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097297

0 1
 I   -2.495900      -3.476300      0.6080000    
 O    2.109300     -0.4274000     -0.9981000    
 O    1.451100       2.229600       1.331600    
 O    3.650400       2.097900     -0.2592000    
 O    3.773600      -2.644500     -0.5773000    
 N  -9.4700001E-02 -0.1040000     -0.1808000    
 N   -1.474600       1.851900     -0.4768000    
 N   -3.853200       1.385600     -0.2484000    
 N   -4.713400     -0.7760000      0.2176000    
 C    1.214400      0.5147000     -0.3761000    
 C    1.891200      0.9537000      0.9134000    
 C    3.352300      0.9326000      0.5095000    
 C    3.420000     -0.2886000     -0.4021000    
 C    3.744100      -1.572600      0.3488000    
 C   -1.305200      0.5405000     -0.2343000    
 C  -0.3044000      -1.435400      8.7700002E-02
 C   -2.304300     -0.3952000      4.0000002E-03
 C   -1.662100      -1.643500      0.2068000    
 C   -3.616800      7.4800000E-02 -1.0100000E-02
 C   -2.782000       2.182000     -0.4642000    
 H    1.073800       1.347300      -1.076200    
 H    1.709300      0.2372000       1.722700    
 H    4.038300      0.9082000       1.361000    
 H    4.126500     -0.1525000      -1.228800    
 H    2.990700      -1.808400       1.106700    
 H    4.722800      -1.508800      0.8334000    
 H   0.5269000      -2.122500      0.1778000    
 H    1.663700       2.866600      0.6283000    
 H    4.578900       2.029900     -0.5405000    
 H    2.900500      -2.687900      -1.003500    
 H   -3.005200       3.226700     -0.6521000    
 H   -4.571200      -1.760200      0.3986000    
 H   -5.647700     -0.3903000      0.1978000    


%chk=000097297-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097297

0 1
I -2.741356 -3.217082 1.663011
O 1.964565 -0.418781 -0.892423
O 1.650968 1.932725 1.949782
O 3.568474 2.215541 0.147822
O 3.759295 -2.509154 -1.319242
N -0.150408 -0.083968 0.165183
N -1.486963 1.641057 -0.955875
N -3.895549 1.210035 -0.944045
N -4.882085 -0.669747 0.034327
C 1.146242 0.511661 -0.068312
C 2.015003 0.755910 1.201505
C 3.445890 0.819315 0.601650
C 3.410818 -0.187992 -0.569398
C 4.009205 -1.563641 -0.236027
C -1.358495 0.467826 -0.276225
C -0.425982 -1.297509 0.821331
C -2.423450 -0.406484 0.118466
C -1.800600 -1.513821 0.806021
C -3.737707 0.030635 -0.255873
C -2.782087 1.939112 -1.253735
H 0.969732 1.458614 -0.611598
H 1.922418 -0.096432 1.895925
H 4.227802 0.580904 1.348471
H 3.890114 0.226790 -1.476433
H 3.589969 -1.936086 0.725671
H 5.107736 -1.499383 -0.144020
H 0.368406 -1.923704 1.218076
H 2.041637 2.712397 1.468445
H 4.489305 2.412666 -0.148944
H 2.794522 -2.446647 -1.548551
H -2.955409 2.868692 -1.803304
H -4.856564 -1.553260 0.539483
H -5.768344 -0.275088 -0.275966


