%chk=000091205.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091205

0 1
 O   -6.686300      -2.376400     -0.6119000    
 O   -1.036500      0.1073000       1.619600    
 O    4.894200      0.2976000     -0.5011000    
 O    8.163800     -0.8987000     -0.2008000    
 O    7.261100      0.5667000      -1.570100    
 N   -3.181800      0.9931000      0.1501000    
 N   -5.601500     -0.3298000     -0.4079000    
 N   0.3982000       1.071500      7.5800002E-02
 N    1.465000      0.3707000      0.5245000    
 N    7.156100     -0.2510000     -0.6096000    
 C   -3.122200     -0.3111000     -0.5259000    
 C   -4.312900       1.805900     -0.2933000    
 C   -4.437600     -0.7465000      -1.182500    
 C   -5.616600       1.070600      2.5000000E-02
 C   -1.917400       1.711900      4.2399999E-02
 C   -6.654100      -1.219000     -0.1888000    
 C  -0.8291000      0.8785000      0.6850000    
 C   -7.806800     -0.6898000      0.6298000    
 C    2.563700      0.6192000     -0.1129000    
 C    3.814400     -3.8300000E-02  0.2273000    
 C    4.093800     -0.9606000       1.180700    
 C    5.916600     -0.4410000      4.1999999E-03
 C    5.475900      -1.231100       1.040300    
 H   -2.857000      -1.066900      0.2231000    
 H   -2.346800     -0.3433000      -1.302500    
 H   -4.243700       2.018900      -1.368000    
 H   -4.327200       2.770900      0.2274000    
 H   -4.537800     -0.2833000      -2.172200    
 H   -4.437800      -1.830900      -1.335300    
 H   -5.801600       1.086200       1.105300    
 H   -6.458500       1.572400     -0.4641000    
 H   -1.959000       2.656500      0.5978000    
 H   -1.674200       1.940500      -1.002300    
 H   -8.574300      -1.464600      0.7195000    
 H   -8.255000      0.1792000      0.1420000    
 H   -7.467100     -0.4265000       1.634700    
 H   0.5359000       1.717600     -0.6954000    
 H    2.604800       1.343900     -0.9474000    
 H    3.410800      -1.397200       1.895200    
 H    6.070800      -1.918000       1.625700    


%chk=000091205-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000091205

0 1
O -7.016499 -2.196424 -0.714135
O -1.012722 -0.187774 1.206377
O 5.156923 0.394637 -0.384210
O 8.424393 -0.795999 0.481868
O 7.748828 0.701060 -1.133399
N -3.224618 0.905364 -0.280541
N -5.830533 -0.217281 -0.394995
N 0.468867 0.908131 -0.253998
N 1.590072 0.314527 0.265811
N 7.518595 -0.117373 -0.158533
C -3.410045 -0.410772 -0.947500
C -4.391776 1.797794 -0.271341
C -4.858983 -0.576080 -1.448694
C -5.604529 1.057606 0.328207
C -1.911266 1.500474 -0.386176
C -6.863937 -1.101144 -0.086206
C -0.815630 0.635959 0.290045
C -7.802918 -0.677848 1.041576
C 2.755191 0.621905 -0.277065
C 3.952186 0.010370 0.244847
C 4.225594 -0.913929 1.266222
C 6.167104 -0.313470 0.274624
C 5.639511 -1.118978 1.283497
H -3.150392 -1.222183 -0.242114
H -2.731484 -0.503112 -1.828241
H -4.659837 2.198052 -1.281114
H -4.172174 2.670300 0.371640
H -5.027527 0.049004 -2.348476
H -5.059256 -1.623676 -1.728114
H -5.397759 0.858046 1.397953
H -6.499170 1.709568 0.264413
H -1.913558 2.480791 0.132174
H -1.591255 1.703706 -1.447426
H -8.532066 -1.486327 1.194633
H -8.347922 0.251181 0.789874
H -7.256952 -0.501601 1.986511
H 0.534802 1.562721 -1.051174
H 2.890368 1.325465 -1.119513
H 3.476164 -1.371411 1.907455
H 6.216510 -1.766179 1.938636


