%chk=000177762.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177762

0 1
 O   -2.689700      -1.323200     -0.6573000    
 O   -3.833500     -0.7231000       1.253800    
 N    1.696600       3.838900      0.3726000    
 C    1.456300      -1.719500      0.4483000    
 C    2.592100      -1.239600     -0.4601000    
 C   0.1215000      -1.884000     -0.2819000    
 C    3.908500      -1.004200      0.2838000    
 C  -0.9793000      -2.341100      0.6743000    
 C    4.984700     -0.4582000     -0.6557000    
 C   -2.302300      -2.547800     -4.9699999E-02
 C   -1.646400       1.955600      0.1204000    
 C   -2.499900       1.532700      -1.080200    
 C   -3.759200      0.7735000     -0.6626000    
 C  -0.3754000       2.681000     -0.3336000    
 C    6.284400     -0.1859000      8.4799998E-02
 C   -3.462600     -0.4921000      0.1111000    
 C   0.5043000       3.136900      0.8320000    
 H    1.742800      -2.674700      0.9054000    
 H    1.329200      -1.001300       1.268100    
 H    2.283800     -0.3059000     -0.9475000    
 H    2.750800      -1.975600      -1.257900    
 H   0.2376000      -2.615700      -1.090500    
 H  -0.1510000     -0.9295000     -0.7468000    
 H    4.249100      -1.944100      0.7345000    
 H    3.742300     -0.2938000       1.102800    
 H  -0.6859000      -3.279800       1.158300    
 H   -1.100700      -1.589000       1.462900    
 H    4.636900      0.4715000      -1.121100    
 H    5.172200      -1.175300      -1.463300    
 H   -2.188600      -3.291100     -0.8462000    
 H   -3.071700      -2.928500      0.6319000    
 H   -2.232300       2.612700      0.7741000    
 H   -1.359900       1.079900      0.7137000    
 H   -2.797200       2.422300      -1.648500    
 H   -1.898300      0.9120000      -1.755000    
 H  -0.6560000       3.553100     -0.9382000    
 H   0.2040000       2.015400     -0.9865000    
 H   -4.355600      0.5046000      -1.541500    
 H   -4.388500       1.413900     -3.3399999E-02
 H    6.136700      0.5545000      0.8776000    
 H    7.040000      0.2020000     -0.6057000    
 H    6.676600      -1.101800      0.5382000    
 H  -6.6900000E-02   3.803200       1.487400    
 H   0.8065000       2.268900       1.428800    
 H    2.281900       4.071500       1.173800    
 H    2.251900       3.220400     -0.2173000    


%chk=000177762-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000177762

0 1
O -2.891374 -1.286807 -0.702132
O -3.846565 -0.727884 1.352949
N 2.248809 3.087467 0.149707
C 1.312009 -1.664470 0.449479
C 2.451240 -1.143321 -0.455748
C 0.029821 -2.022104 -0.334864
C 3.686033 -0.650460 0.331924
C -1.125197 -2.491454 0.578392
C 4.818024 -0.115130 -0.574375
C -2.474874 -2.612063 -0.145657
C -1.417817 1.845655 0.140671
C -2.448151 1.593911 -0.983104
C -3.764506 0.941869 -0.477540
C -0.079834 2.404533 -0.391503
C 6.030677 0.413070 0.221964
C -3.531421 -0.408669 0.182882
C 0.972596 2.606757 0.718279
H 1.665325 -2.549434 1.018987
H 1.066507 -0.887595 1.204409
H 2.062866 -0.309970 -1.080273
H 2.757775 -1.941700 -1.163448
H 0.256680 -2.808782 -1.084217
H -0.302708 -1.133204 -0.906827
H 4.079990 -1.477661 0.958692
H 3.373545 0.150553 1.034926
H -0.883683 -3.481863 1.016285
H -1.244523 -1.794095 1.430022
H 4.417783 0.695128 -1.219881
H 5.146614 -0.920174 -1.262625
H -2.410690 -3.257715 -1.037414
H -3.264914 -2.971849 0.537060
H -1.845939 2.545192 0.888081
H -1.224311 0.896014 0.681539
H -2.698961 2.552708 -1.478120
H -2.002634 0.937843 -1.754596
H -0.237099 3.371420 -0.907303
H 0.327261 1.702914 -1.151602
H -4.453314 0.800191 -1.332123
H -4.264793 1.586661 0.265312
H 5.732339 1.238418 0.896520
H 6.823274 0.793595 -0.448177
H 6.471642 -0.385585 0.847908
H 0.605945 3.372018 1.429717
H 1.065296 1.652122 1.295872
H 2.929570 3.414272 0.842170
H 2.671487 2.439381 -0.524118


