%chk=000148059.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148059

0 1
 O   -2.749200      -1.581300      -2.941000    
 O   -2.488000      0.6830000      -1.296900    
 N   -3.001900      -2.202700      0.6966000    
 N    5.760200      0.4112000      0.5328000    
 C   -2.067900      -2.819200       1.644500    
 C   -2.424700      -2.162900     -0.6363000    
 C   -2.724600      -2.847600       3.028900    
 C   -1.767900      -4.246800       1.175500    
 C  -0.7744000      -1.997300       1.691800    
 C   -3.370700      -1.521200      -1.654000    
 C   -3.700000     -6.4000003E-02  -1.337400    
 C   -2.465700       1.774900     -0.4709000    
 C   -1.282400       2.196900      0.1290000    
 C   -3.655600       2.460000     -0.2401000    
 C   -1.289100       3.312500      0.9662000    
 C   -3.662100       3.575800      0.5969000    
 C    4.578700     -2.0000000E-02 -0.1055000    
 C   -2.479000       4.002000       1.200100    
 C    2.212100      0.2286000     -0.5156000    
 C    3.379000      0.6563000      0.1161000    
 C  -5.1500000E-02   1.503500     -9.8300003E-02
 C    4.610000      -1.123300     -0.9584000    
 C    2.242300     -0.8739000      -1.368400    
 C    3.441900      -1.550100      -1.590000    
 C    7.049500      0.2151000     -9.9600002E-02
 C    5.699400       1.068600       1.823100    
 C   0.9815000      0.9217000     -0.2889000    
 H   -3.222000      -1.258200       1.009700    
 H   -1.477400      -1.616600     -0.6840000    
 H   -2.220300      -3.167900      -1.020100    
 H   -3.660100      -3.419200       3.014800    
 H   -2.065100      -3.312200       3.770800    
 H   -2.956800      -1.835900       3.382000    
 H   -1.096400      -4.293500      0.3117000    
 H   -2.685400      -4.797800      0.9357000    
 H   -1.263600      -4.806900       1.973100    
 H  -0.9779000     -0.9294000       1.832500    
 H  -0.1573000      -2.314900       2.541700    
 H  -0.1431000      -2.119400      0.8061000    
 H   -4.304900      -2.092300      -1.716600    
 H   -4.259400     -2.0600000E-02 -0.3955000    
 H   -4.320800      0.3459000      -2.143300    
 H   -2.607500      -2.519100      -3.155700    
 H   -4.593700       2.187600     -0.7138000    
 H  -0.3754000       3.658300       1.444100    
 H   -4.586700       4.117900      0.7731000    
 H   -2.484000       4.871900       1.850500    
 H    3.337600       1.525900      0.7680000    
 H    5.524500      -1.679700      -1.143100    
 H    1.339300      -1.219500      -1.866100    
 H    3.465400      -2.411000      -2.251800    
 H    7.010200      0.4445000      -1.170500    
 H    7.394900     -0.8154000      3.4400001E-02
 H    7.808100      0.8753000      0.3358000    
 H    6.670700       1.034700       2.329300    
 H    4.980600      0.5791000       2.490100    
 H    5.424400       2.122500       1.709300    


%chk=000148059-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000148059

0 1
O -3.381204 -1.285216 -2.976553
O -2.577853 0.601016 -0.666280
N -2.424330 -2.157979 0.584680
N 5.761544 0.673236 0.673580
C -1.788476 -3.278796 1.350562
C -2.317766 -2.150926 -0.888589
C -1.910127 -2.899593 2.847030
C -2.576096 -4.588246 1.092470
C -0.286845 -3.478564 0.986126
C -3.555368 -1.468861 -1.522005
C -3.854642 -0.082285 -0.950312
C -2.626040 1.914488 -0.194842
C -1.357129 2.496337 0.140593
C -3.819589 2.656997 -0.035639
C -1.337320 3.834530 0.624950
C -3.765767 3.983936 0.447777
C 4.565565 0.155108 0.160697
C -2.526175 4.576832 0.777510
C 2.123413 0.359019 -0.241067
C 3.340752 0.879616 0.276440
C -0.148528 1.747143 0.002412
C 4.532658 -1.118163 -0.495979
C 2.114262 -0.910550 -0.891023
C 3.321716 -1.626642 -1.007584
C 7.007980 -0.088484 0.540289
C 5.771921 1.984669 1.330713
C 0.908996 1.108542 -0.106517
H -2.116793 -1.246338 0.953505
H -1.413529 -1.626959 -1.267460
H -2.280217 -3.195016 -1.254793
H -2.969539 -2.741635 3.116841
H -1.496242 -3.698789 3.487477
H -1.353445 -1.967700 3.065557
H -2.512633 -4.905399 0.034624
H -3.640924 -4.445243 1.347117
H -2.168627 -5.410654 1.708694
H 0.291001 -2.554550 1.173947
H 0.160940 -4.293942 1.584854
H -0.166843 -3.741713 -0.081726
H -4.448665 -2.100464 -1.322300
H -4.427574 -0.177467 -0.008192
H -4.438403 0.487763 -1.697792
H -3.040524 -2.127033 -3.372338
H -4.788244 2.214870 -0.283671
H -0.368859 4.277791 0.878742
H -4.696098 4.550611 0.564854
H -2.487255 5.605295 1.150590
H 3.313099 1.855199 0.768186
H 5.446433 -1.707926 -0.608941
H 1.177217 -1.304355 -1.295905
H 3.326089 -2.602247 -1.507441
H 7.274941 -0.265893 -0.522261
H 6.945218 -1.075216 1.044025
H 7.832610 0.474658 1.005202
H 6.795331 2.220595 1.662863
H 5.112160 2.005377 2.222672
H 5.441623 2.793115 0.646035


