%chk=000004916.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004916

0 1
 O   -1.819200     -1.8200001E-02  -2.489300    
 O    3.246300      -2.731700      4.6100002E-02
 O    4.520900       1.891500       1.261600    
 N   -2.655700     -0.7073000      0.2871000    
 N    3.393000      2.6900001E-02  0.5176000    
 C   -2.234500      0.6279000     -0.1575000    
 C   -1.191100      0.5009000      -1.308100    
 C   -3.476300       1.452600     -0.5519000    
 C   6.8000001E-03 -0.3112000     -0.9320000    
 C   -3.530900     -0.6065000       1.441600    
 C    1.151700      0.2640000     -0.3734000    
 C   -3.143700       2.888600     -0.9432000    
 C  -4.3499999E-02  -1.688600      -1.156900    
 C    2.240500     -0.5517000     -4.4300001E-02
 C   -2.805500      7.6899998E-02   2.597300    
 C   -4.007400      -1.999500       1.840800    
 C    2.192100      -1.928900     -0.2685000    
 C    1.243300       1.700300     -0.1229000    
 C    1.046100      -2.495100     -0.8257000    
 C    2.349300       2.229800      0.4122000    
 C    3.517700       1.379400      0.7694000    
 H   -1.703300       1.147200      0.6474000    
 H  -0.8655000       1.494900      -1.622900    
 H   -4.171700       1.567800      0.2830000    
 H   -4.034900      0.9707000      -1.363000    
 H   -3.136900      -1.185200     -0.4746000    
 H   -4.459300     -7.0699997E-02   1.228900    
 H   -2.585200       2.932500      -1.882300    
 H   -4.065800       3.461700      -1.085900    
 H   -2.555600       3.383400     -0.1637000    
 H  -0.9209000      -2.164800      -1.587000    
 H   -3.359700     -6.8200000E-02   3.532300    
 H   -1.802900     -0.3382000       2.752600    
 H   -2.722000       1.159800       2.462200    
 H   -4.550100      -2.482200       1.020100    
 H   -4.685400      -1.948700       2.700000    
 H   -3.166700      -2.646400       2.116800    
 H   -2.409700      0.6685000      -2.841600    
 H   0.4180000       2.365900     -0.3373000    
 H   0.9877000      -3.564900      -1.007800    
 H    4.169200     -0.5870000      0.7479000    
 H    2.422900       3.293200      0.6110000    
 H    3.024700      -3.650900     -0.1818000    


%chk=000004916-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000004916

0 1
O -2.090809 -0.458552 -2.434345
O 3.365062 -2.569985 0.170183
O 4.379290 1.954175 1.416246
N -2.770479 -0.580102 0.308412
N 3.239878 0.093718 0.574948
C -2.268622 0.691402 -0.231315
C -1.342519 0.358842 -1.451361
C -3.379627 1.722893 -0.617738
C -0.097141 -0.423430 -1.059185
C -3.560031 -0.605933 1.558533
C 1.011371 0.241081 -0.436657
C -2.858191 3.147929 -0.913148
C -0.028810 -1.807716 -1.283352
C 2.150923 -0.525678 -0.036449
C -2.736448 -0.052340 2.743171
C -3.986588 -2.065059 1.824149
C 2.187564 -1.927923 -0.266938
C 1.082071 1.670740 -0.181502
C 1.107650 -2.563470 -0.894197
C 2.175417 2.254318 0.421435
C 3.345292 1.475962 0.852101
H -1.629604 1.168459 0.538585
H -1.046953 1.312482 -1.934952
H -4.097797 1.774347 0.223382
H -3.964973 1.340438 -1.482248
H -3.146686 -1.182081 -0.434446
H -4.495118 0.007666 1.483032
H -2.209357 3.182834 -1.808049
H -3.694443 3.848648 -1.089024
H -2.273685 3.537330 -0.057644
H -0.867355 -2.300513 -1.778285
H -3.311910 -0.139331 3.682887
H -1.795592 -0.622698 2.844893
H -2.479922 1.014672 2.608638
H -4.585619 -2.467330 0.984165
H -4.600192 -2.132139 2.740221
H -3.092530 -2.702854 1.946744
H -2.789842 0.109031 -2.845154
H 0.245893 2.308775 -0.486832
H 1.135384 -3.644347 -1.081413
H 4.034699 -0.496834 0.844026
H 2.229247 3.330752 0.605562
H 3.337901 -3.539677 -0.012779


