%chk=000153928.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153928

0 1
 O   -3.250400       3.006100     -8.9999998E-04
 O    3.230300       3.015300     -0.2618000    
 O   -5.344200       1.185700     -9.7900003E-02
 O    5.335900       1.223800     -5.5999998E-03
 N   -2.340500      -2.422100      2.2700001E-02
 N    2.355100      -2.400100      0.1870000    
 C   6.3999998E-03  -2.115700      9.1899998E-02
 C  -0.7571000      -4.369800      0.1488000    
 C   0.7841000      -4.361400      0.2304000    
 C   -1.099500      -2.905000      8.6599998E-02
 C    1.117300      -2.894500      0.1653000    
 C   1.9000000E-03 -0.7274000      3.1500001E-02
 C   -1.360500     -0.1737000      9.3000000E-03
 C    1.360900     -0.1652000      5.2999998E-03
 C   -2.470600      -1.085400     -8.7000001E-03
 C    2.476700      -1.065000      0.1022000    
 C   -1.690400       1.203700      2.4700001E-02
 C    1.682100       1.207600     -0.1297000    
 C   -3.772700     -0.5999000     -5.1100001E-02
 C    3.775800     -0.5692000      0.1019000    
 C   -3.008400       1.665700     -1.3800000E-02
 C    2.997200       1.679600     -0.1316000    
 C   -4.051800      0.7618000     -5.9099998E-02
 C    4.046300      0.7897000     -8.1000002E-03
 C   -3.404000       3.624800       1.275100    
 C    3.302800       3.780700      0.9395000    
 C   -5.918600       1.402300      -1.386100    
 C    5.995700       1.307700      -1.268000    
 H   -1.200000      -4.839600       1.032500    
 H   -1.103500      -4.887300     -0.7513000    
 H    1.230100      -4.903200     -0.6094000    
 H    1.133500      -4.796700       1.171900    
 H  -0.9288000       1.966500      9.1899998E-02
 H   0.9161000       1.956600     -0.2657000    
 H   -4.605400      -1.302900     -7.1599998E-02
 H    4.612800      -1.262500      0.1851000    
 H   -2.488300       3.518500       1.865500    
 H   -4.251700       3.190600       1.814500    
 H   -3.597500       4.689400       1.118400    
 H    4.120100       3.424900       1.574700    
 H    2.354300       3.730500       1.483700    
 H    3.497100       4.822600      0.6707000    
 H   -5.366000       2.175600      -1.928900    
 H   -6.949500       1.739900      -1.248900    
 H   -5.928100      0.4718000      -1.962600    
 H    7.011100       1.676700      -1.099600    
 H    5.474400       2.006700      -1.929500    
 H    6.054900      0.3199000      -1.735800    


%chk=000153928-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000153928

0 1
O -3.129784 2.993030 0.090672
O 3.103126 2.992954 -0.418045
O -5.379868 1.138962 -0.217921
O 5.377358 1.194053 -0.025727
N -2.393222 -2.616182 0.033356
N 2.417589 -2.574053 0.343535
C 0.010668 -2.289160 0.171578
C -0.762277 -4.576264 0.263753
C 0.802921 -4.560557 0.393660
C -1.161248 -3.108127 0.151655
C 1.189672 -3.087813 0.301095
C 0.004495 -0.879699 0.074048
C -1.337166 -0.293469 0.032203
C 1.341167 -0.280956 0.033513
C -2.479077 -1.210684 -0.015514
C 2.491123 -1.174287 0.198062
C -1.635525 1.102951 0.084738
C 1.624430 1.104552 -0.169412
C -3.800064 -0.686176 -0.118148
C 3.810510 -0.636542 0.175698
C -2.943491 1.593414 0.029350
C 2.928423 1.610171 -0.183552
C -4.047028 0.687074 -0.129338
C 4.047168 0.724113 -0.023515
C -3.921136 3.463064 1.254286
C 3.720663 3.735829 0.707642
C -5.671468 1.995674 -1.393398
C 5.829178 1.778726 -1.312201
H -1.250324 -5.046398 1.136090
H -1.099375 -5.136391 -0.627019
H 1.295503 -5.143177 -0.405144
H 1.143735 -4.989039 1.353457
H -0.857172 1.851223 0.228920
H 0.835424 1.833091 -0.351507
H -4.631280 -1.391629 -0.192890
H 4.650242 -1.326369 0.290798
H -3.379819 3.239387 2.192815
H -4.918108 2.988004 1.273831
H -4.012478 4.551827 1.123663
H 4.703031 3.306346 0.973271
H 3.049562 3.712847 1.586971
H 3.833394 4.769673 0.348112
H -5.004820 2.876121 -1.419298
H -6.720273 2.305908 -1.273637
H -5.555796 1.408000 -2.323214
H 6.850027 2.143345 -1.123556
H 5.170092 2.608451 -1.624410
H 5.846701 0.996284 -2.093925


