%chk=000178925.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178925

0 1
 O    2.035600      0.4363000      -1.394100    
 O    4.373800      7.4600004E-02 -0.2995000    
 N   0.8623000      4.2300001E-02  0.6101000    
 C   -1.204300     -0.9118000     -0.2112000    
 C  -0.4789000      0.1909000      0.2403000    
 C  -0.5767000      -2.264300     -0.3120000    
 C   -1.091100       1.441600      0.3239000    
 C   -2.541700     -0.7636000     -0.5790000    
 C   -2.428400       1.589700     -4.3800000E-02
 C   -3.153700      0.4871000     -0.4953000    
 C  -0.7298000      -3.069400      0.9745000    
 C  -0.3408000       2.641500      0.8044000    
 C    1.997800      0.1714000     -0.1964000    
 C    3.275900     -6.6299997E-02  0.5781000    
 H   -1.041000      -2.822800      -1.135500    
 H   0.4822000      -2.197900     -0.5847000    
 H   -3.120400      -1.613700     -0.9305000    
 H   -2.921000       2.556700      1.4700000E-02
 H    1.009000     -0.1575000       1.597200    
 H   -4.195200      0.6022000     -0.7812000    
 H  -0.2427000      -2.568500       1.817700    
 H  -0.2737000      -4.057600      0.8577000    
 H   -1.785100      -3.211100       1.231200    
 H   8.4500000E-02   2.458500       1.796900    
 H   0.4642000       2.893100      0.1062000    
 H  -0.9890000       3.520600      0.8893000    
 H    3.363900      0.6761000       1.376300    
 H    3.278400      -1.071200       1.010400    
 H    4.328000     -0.6509000     -0.9455000    


%chk=000178925-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000178925

0 1
O 2.043971 1.172672 -0.962859
O 4.467274 0.428113 -0.116370
N 0.877341 -0.194829 0.554327
C -1.303796 -1.026903 -0.220014
C -0.484256 0.079262 0.154471
C -0.765311 -2.452236 -0.224420
C -0.989137 1.411750 0.178996
C -2.648024 -0.777186 -0.583229
C -2.337753 1.614930 -0.208252
C -3.164012 0.536240 -0.586283
C -0.815924 -3.133522 1.171643
C -0.140699 2.586591 0.618672
C 2.021502 0.334720 -0.009450
C 3.354959 -0.150160 0.603453
H -1.363858 -3.058976 -0.928237
H 0.274165 -2.465633 -0.605120
H -3.284651 -1.619050 -0.880351
H -2.740136 2.634465 -0.198789
H 1.009519 -0.946919 1.236389
H -4.203817 0.718290 -0.879089
H -0.210730 -2.595005 1.927488
H -0.435786 -4.169792 1.117396
H -1.852095 -3.164503 1.552653
H 0.447748 2.346118 1.523725
H 0.584887 2.858501 -0.169386
H -0.770671 3.464780 0.838864
H 3.396290 0.150136 1.671504
H 3.409705 -1.257772 0.550222
H 4.065394 1.031917 -0.807753


