%chk=000019253.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019253

0 1
 O    1.805600      -2.381900     -7.7999998E-03
 O   -2.696000      -1.982300      0.5156000    
 O   6.1000001E-02   1.541300       1.760900    
 N   0.9835000     -0.3416000      0.7581000    
 N   -1.378200     -0.1331000       1.035000    
 N    4.264100       1.392700      0.3128000    
 C  -0.5007000      -1.856100     -0.4721000    
 C   0.8743000      -1.586300      0.1211000    
 C  -0.6650000      -3.362900     -0.7356000    
 C  -0.5913000      -1.107600      -1.814800    
 C   -1.635600      -1.363900      0.4140000    
 C    2.322200      0.1298000       1.096700    
 C  -0.1003000      0.4480000       1.207600    
 C    2.940700      0.9070000     -5.6000002E-02
 C   -2.500300      0.5575000       1.662100    
 C  -0.7134000      -4.123200      0.5482000    
 C   0.4522000      -1.595500      -2.763500    
 C   -3.195800       1.482800      0.7059000    
 C    5.132400      0.2799000      0.7027000    
 C    4.865600       2.141900     -0.7921000    
 C   -1.760200      -4.861100      0.9347000    
 C    1.390300     -0.8090000      -3.302900    
 C    6.494800      0.7787000       1.153600    
 C    3.981100       3.302800      -1.214100    
 C   -2.776400       2.803700      0.5996000    
 C   -4.251900       1.009400     -6.3800000E-02
 C   -3.422200       3.663500     -0.2888000    
 C   -4.897700       1.869100     -0.9524000    
 C   -4.482800       3.196200      -1.064800    
 H   -1.572800      -3.552100      -1.324500    
 H   0.1687000      -3.785800      -1.307600    
 H   -1.578600      -1.262700      -2.269700    
 H  -0.4997000     -2.3300000E-02  -1.668200    
 H    2.283700      0.7516000       1.999400    
 H    2.894200     -0.7652000       1.352000    
 H    2.257300       1.734200     -0.2766000    
 H    2.986500      0.2760000     -0.9523000    
 H   -2.160100       1.117900       2.541900    
 H   -3.218000     -0.1776000       2.048100    
 H   0.1569000      -4.098900       1.198200    
 H   0.4092000      -2.624300      -3.108800    
 H    5.249200     -0.4560000     -0.1026000    
 H    4.744900     -0.2422000       1.580800    
 H    5.069000       1.500600      -1.659000    
 H    5.814600       2.591000     -0.4819000    
 H   -2.655400      -4.941500      0.3280000    
 H   -1.733300      -5.401400       1.874600    
 H    1.469600      0.2409000      -3.043400    
 H    2.098900      -1.210400      -4.019000    
 H    7.121600       1.098600      0.3156000    
 H    6.409700       1.603000       1.870100    
 H    7.036300     -3.2600001E-02   1.653800    
 H    3.109400       2.977500      -1.790500    
 H    4.548900       3.977000      -1.865600    
 H    3.642700       3.891200     -0.3542000    
 H   -1.957600       3.185400       1.201800    
 H   -4.588600     -2.0099999E-02  1.5699999E-02
 H   -3.100400       4.697200     -0.3752000    
 H   -5.724200       1.505700      -1.556100    
 H   -4.986000       3.865700      -1.756200    


%chk=000019253-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019253

0 1
O 1.867467 -2.369955 -0.045291
O -2.891806 -1.850725 0.191008
O -0.034080 1.506447 1.708131
N 0.929953 -0.409923 0.785165
N -1.468355 -0.176703 0.950234
N 4.237966 1.352391 0.166747
C -0.530654 -2.075205 -0.401940
C 0.839922 -1.663531 0.140135
C -0.695758 -3.626613 -0.336536
C -0.625430 -1.570939 -1.914515
C -1.719891 -1.397555 0.291092
C 2.286890 0.127996 1.094579
C -0.181712 0.377779 1.165566
C 2.816888 1.012719 -0.061010
C -2.646703 0.624274 1.429211
C -0.535731 -4.192287 1.061601
C 0.543549 -1.958520 -2.791122
C -3.191385 1.558385 0.354168
C 5.162515 0.317510 -0.372993
C 4.591950 2.741017 -0.228642
C -1.544996 -4.725691 1.794157
C 1.242091 -1.077649 -3.550039
C 6.517798 0.275390 0.357789
C 4.053532 3.795194 0.757350
C -2.659108 2.864864 0.202033
C -4.240282 1.132960 -0.501114
C -3.165596 3.730525 -0.792964
C -4.746245 1.999649 -1.496110
C -4.210366 3.300256 -1.644467
H -1.697330 -3.868107 -0.732349
H 0.067780 -4.073667 -0.998188
H -1.564852 -2.011128 -2.305256
H -0.750213 -0.471250 -1.928367
H 2.229282 0.718620 2.020384
H 2.948520 -0.738534 1.246125
H 2.215261 1.937670 -0.097788
H 2.664660 0.476889 -1.029033
H -2.300542 1.191654 2.306635
H -3.407264 -0.111999 1.733235
H 0.482457 -4.165424 1.476881
H 0.815014 -3.022433 -2.818336
H 5.327827 0.458872 -1.471446
H 4.668221 -0.665714 -0.261239
H 4.237131 2.973613 -1.264866
H 5.694422 2.812365 -0.253226
H -2.572050 -4.765958 1.411388
H -1.371500 -5.130063 2.798168
H 1.006818 -0.005534 -3.554142
H 2.063826 -1.405407 -4.195945
H 7.074830 1.224227 0.254291
H 6.363526 0.087704 1.434645
H 7.152221 -0.530766 -0.055646
H 2.951154 3.765531 0.830708
H 4.341870 4.812644 0.432760
H 4.463490 3.614413 1.766137
H -1.846311 3.189945 0.861341
H -4.648057 0.122247 -0.385848
H -2.751421 4.739359 -0.900906
H -5.558637 1.663811 -2.150382
H -4.605957 3.973561 -2.413456


