%chk=000037424.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037424

0 1
 O   -3.559000      -2.459900      9.0800002E-02
 O    4.464400       1.839100      0.9775000    
 N  -0.5170000      0.5394000     -0.2570000    
 C   -2.666300     -0.2791000      0.7736000    
 C   -3.927900      -1.127400      0.4714000    
 C   -4.688700     -0.4240000     -0.6747000    
 C   -1.732600     -0.2498000     -0.4732000    
 C   -3.830300     -0.3589000      -1.957700    
 C   -2.424100      0.2144000      -1.763700    
 C   -3.082900       1.121400       1.279100    
 C   -5.159900      0.9792000     -0.2420000    
 C   -4.074500       1.861800      0.3794000    
 C   -4.808400      -1.342400       1.713100    
 C   0.4127000      0.3735000      -1.379400    
 C   0.1162000      0.1738000       1.014900    
 C    2.418200      0.9222000      0.1221000    
 C    1.653900       1.250000      -1.188500    
 C    1.378100       1.008500       1.271300    
 C    3.209700     -0.3905000      2.6400000E-02
 C    3.413300       2.036100      0.3697000    
 C    3.054500       3.395600     -0.1665000    
 C    4.183800     -0.5415000     -0.9570000    
 C    2.949600      -1.422900      0.9239000    
 C    4.902800      -1.733600      -1.043800    
 C    3.668800      -2.614900      0.8370000    
 C    4.645400      -2.770100     -0.1468000    
 H   -2.147000     -0.8015000       1.587200    
 H   -5.578400      -1.016300     -0.9288000    
 H   -1.429400      -1.294100     -0.6449000    
 H   -4.353300      0.2082000      -2.737200    
 H   -3.728100      -1.380100      -2.348800    
 H   -1.853900     -0.1008000      -2.645900    
 H   -2.466200       1.306800      -1.818200    
 H   -2.213300       1.768300       1.436800    
 H   -3.533100       1.016000       2.273900    
 H   -5.973600      0.8694000      0.4855000    
 H   -5.606800       1.505300      -1.094700    
 H   -3.528600       2.381700     -0.4133000    
 H   -4.552900       2.663100      0.9567000    
 H   -4.244600      -1.854100       2.502400    
 H   -5.211600     -0.4210000       2.138300    
 H   -5.655800      -1.995000       1.470500    
 H  -2.5800001E-02  0.7074000      -2.324100    
 H   0.7064000     -0.6762000      -1.506900    
 H   0.3197000     -0.9005000       1.040400    
 H  -0.5222000      0.3936000       1.874600    
 H    2.300700       1.153500      -2.069000    
 H    1.269800       2.275600      -1.210600    
 H    1.058900       2.052100       1.405700    
 H    1.825000      0.7332000       2.235400    
 H   -2.988200      -2.825500      0.7881000    
 H    3.147400       3.425500      -1.254600    
 H    2.065400       3.714400      0.1689000    
 H    3.769700       4.121100      0.2370000    
 H    4.406100      0.2545000      -1.661900    
 H    2.239500      -1.349300       1.736900    
 H    5.664700      -1.853900      -1.808400    
 H    3.476500      -3.418800       1.541600    
 H    5.207300      -3.697200     -0.2126000    


%chk=000037424-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000037424

0 1
O -3.694244 -2.492999 -0.313850
O 3.414616 2.641320 1.912125
N -0.639424 0.556765 -0.122758
C -2.840900 -0.378191 0.721454
C -4.101199 -1.199138 0.313975
C -4.845269 -0.422056 -0.799647
C -1.837159 -0.286784 -0.479114
C -3.928845 -0.338097 -2.046970
C -2.512984 0.239520 -1.779207
C -3.263425 1.000796 1.307987
C -5.328580 0.956987 -0.265454
C -4.212470 1.816250 0.388933
C -4.998819 -1.546972 1.519184
C 0.310109 0.677477 -1.263070
C 0.092101 0.030001 1.065502
C 2.307064 1.113829 0.328911
C 1.514621 1.582763 -0.926118
C 1.262546 0.945336 1.467329
C 3.148108 -0.172681 0.114009
C 3.344522 2.212340 0.730382
C 4.273298 2.740110 -0.356776
C 3.354270 -0.766985 -1.158309
C 3.808250 -0.753906 1.231855
C 4.169057 -1.912564 -1.305943
C 4.623991 -1.896240 1.088511
C 4.805764 -2.486764 -0.183405
H -2.342184 -0.945891 1.536137
H -5.741190 -1.011132 -1.084116
H -1.500897 -1.336225 -0.684132
H -4.424057 0.272780 -2.828006
H -3.825257 -1.361300 -2.449847
H -1.884003 -0.020676 -2.651379
H -2.545610 1.343375 -1.733739
H -2.350716 1.594158 1.500534
H -3.752118 0.830751 2.287625
H -6.138847 0.789072 0.471506
H -5.789099 1.521473 -1.100360
H -3.616733 2.314057 -0.395291
H -4.677193 2.630066 0.979729
H -4.418602 -2.089249 2.292562
H -5.440521 -0.659388 2.001061
H -5.821410 -2.202493 1.181683
H -0.214665 1.128197 -2.120843
H 0.665116 -0.334442 -1.586655
H 0.464937 -1.011064 0.879435
H -0.601640 -0.020444 1.921137
H 2.164349 1.661569 -1.817504
H 1.122519 2.597769 -0.720360
H 0.865140 1.944764 1.723092
H 1.737489 0.555815 2.383340
H -3.243593 -3.039459 0.380487
H 4.642556 1.923479 -1.000806
H 3.725029 3.452957 -1.002756
H 5.120514 3.271373 0.104246
H 2.878734 -0.344859 -2.048989
H 3.697103 -0.298384 2.222511
H 4.304329 -2.355815 -2.299245
H 5.122422 -2.320791 1.967319
H 5.437199 -3.374759 -0.298013


