%chk=000147128.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147128

0 1
 O   -4.312400      -1.488500       1.316100    
 O    2.775700       2.508100      -1.530600    
 O    4.038800       3.578400      0.2206000    
 N   -4.385800      0.3859000     -6.0600001E-02
 C   -4.636200       3.275900     -8.3400004E-02
 C   -5.021100       2.450200       1.141200    
 C   -3.557100       2.564500     -0.8948000    
 C   -5.427600       1.036000      0.7401000    
 C   -3.969800       1.137400      -1.255000    
 C   -3.915500     -0.8662000      0.3292000    
 C   -2.870000      -1.498300     -0.5001000    
 C   -1.992900      -2.319300      8.9400001E-02
 C    1.054700      -4.501700     -0.8047000    
 C    2.443300      -4.126200     -0.2767000    
 C  -0.9351000      -2.983600     -0.6384000    
 C    3.337600     -0.4348000      0.5648000    
 C    3.148200       1.635700     -0.5548000    
 C  -5.0700001E-02  -3.808200     -5.7799999E-02
 C    3.869500       2.246900      0.4451000    
 C    2.863400      0.2860000     -0.5236000    
 C    2.722200      -2.653100     -0.3971000    
 C    3.060600      -1.877700      0.6448000    
 C    4.071500      0.1736000       1.587300    
 C    4.345900       1.542000       1.531400    
 C    3.342900       3.737000      -1.032500    
 H   -4.277000       4.262300      0.2302000    
 H   -5.520900       3.438400     -0.7109000    
 H   -5.843900       2.937600       1.675600    
 H   -4.167600       2.404300       1.829000    
 H   -2.629900       2.534900     -0.3086000    
 H   -3.343900       3.131100      -1.808000    
 H   -5.653100      0.4515000       1.637600    
 H   -6.338300       1.058700      0.1296000    
 H   -4.825700       1.150100      -1.940200    
 H   -3.140100      0.6615000      -1.777400    
 H   -2.845400      -1.327800      -1.568600    
 H   -2.031900      -2.499600       1.161000    
 H   0.9158000      -5.584500     -0.7009000    
 H   0.9975000      -4.281400      -1.878200    
 H    3.200600      -4.669900     -0.8542000    
 H    2.543600      -4.459400      0.7641000    
 H  -0.8657000      -2.790300      -1.706000    
 H  -0.1162000      -4.011300       1.009000    
 H    2.273700     -0.1446000      -1.324100    
 H    2.664600      -2.257000      -1.406600    
 H    3.142000      -2.323000       1.633700    
 H    4.438600     -0.4020000       2.433600    
 H    4.914400       2.027300       2.316500    
 H    4.046100       4.126300      -1.777700    
 H    2.535700       4.465800     -0.8959000    


%chk=000147128-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000147128

0 1
O -4.146296 -1.152059 1.754550
O 4.697054 2.414497 -1.803356
O 5.168606 3.534536 0.264934
N -4.890553 0.295630 0.089120
C -5.793223 3.080459 -0.101446
C -5.839555 2.300506 1.234234
C -4.673119 2.524921 -1.012121
C -5.969813 0.781164 0.980803
C -4.829805 0.995831 -1.210824
C -4.019125 -0.693239 0.565492
C -2.953816 -1.207598 -0.341932
C -2.052912 -2.132321 0.119051
C 1.016088 -4.290796 -0.962999
C 2.429236 -4.060333 -0.329417
C -0.984281 -2.718290 -0.676601
C 3.754467 -0.433383 0.492135
C 4.448102 1.546464 -0.706374
C -0.099459 -3.639420 -0.184326
C 4.726872 2.209279 0.510935
C 3.964100 0.243727 -0.754884
C 2.925397 -2.640193 -0.474025
C 3.255048 -1.820643 0.564856
C 4.038811 0.250109 1.708632
C 4.526533 1.583176 1.741824
C 5.344967 3.612482 -1.209884
H -5.639711 4.160386 0.082617
H -6.770038 2.977476 -0.619179
H -6.691383 2.639539 1.854402
H -4.913862 2.489100 1.811643
H -3.684788 2.728571 -0.555586
H -4.691967 3.021614 -2.001679
H -5.902053 0.204881 1.916917
H -6.948886 0.566683 0.500969
H -5.773391 0.799137 -1.764977
H -4.001983 0.608615 -1.821698
H -2.888670 -0.868342 -1.381316
H -2.158594 -2.449135 1.166856
H 0.841644 -5.386967 -1.001747
H 1.016074 -3.928340 -2.009333
H 3.136813 -4.752577 -0.832448
H 2.404652 -4.349389 0.739388
H -0.895115 -2.397776 -1.726036
H -0.195058 -3.944285 0.870561
H 3.754577 -0.237555 -1.713213
H 3.012890 -2.276780 -1.509937
H 3.143957 -2.220823 1.584128
H 3.874527 -0.273688 2.657083
H 4.734160 2.095854 2.684181
H 6.426322 3.591956 -1.444054
H 4.839659 4.516339 -1.583420


