%chk=000154721.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154721

0 1
 O    1.995500       2.331500       1.097400    
 O    1.995400       2.332200      -1.097800    
 O    3.557900      5.0400000E-02  -1.096100    
 O    3.557100      4.6300001E-02   1.099000    
 N    1.530600       1.952400     -3.0000001E-04
 N    3.035300     -0.2468000      6.9999998E-04
 C  -0.6547000      -1.137700     -3.0000001E-04
 C   0.5227000     -0.3449000     -6.0000003E-04
 C   -1.939300     -0.4874000       0.000000    
 C   -1.997400      0.9309000      9.9999997E-05
 C   0.4248000       1.048900     -5.0000002E-04
 C  -0.8163000       1.677200       0.000000    
 C    1.791700     -0.9489000     -1.1000000E-03
 C  -0.4746000      -2.543700     -3.0000001E-04
 C   -3.179000      -1.174900      9.9999997E-05
 C   -3.235300       1.595900      5.0000002E-04
 C    1.927000      -2.333700     -1.0000000E-03
 C   0.7933000      -3.131500     -5.0000002E-04
 C   -4.403300     -0.5011000      3.0000001E-04
 C   -4.431300      0.8849000      6.0000003E-04
 H  -0.8717000       2.766200      9.9999997E-05
 H   -1.326400      -3.219000      9.9999997E-05
 H   -3.219000      -2.261200       0.000000    
 H   -3.279500       2.683600      6.0000003E-04
 H    2.905200      -2.808800     -8.9999998E-04
 H   0.8883000      -4.213500     -3.0000001E-04
 H   -5.331800      -1.064700      3.9999999E-04
 H   -5.379900       1.412900      7.9999998E-04


%chk=000154721-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000154721

0 1
O 2.427364 1.624907 1.242596
O 1.502603 3.264158 -0.045189
O 2.982456 0.610989 -1.349321
O 4.210230 -0.800567 -0.044518
N 1.538025 2.062793 0.414052
N 3.091910 -0.335570 -0.476691
C -0.615837 -1.102886 0.116487
C 0.587418 -0.301468 0.047307
C -1.935826 -0.466683 0.018429
C -2.015032 0.963651 -0.136080
C 0.425097 1.141448 0.059932
C -0.811808 1.743452 -0.071630
C 1.837397 -1.001157 -0.031505
C -0.491654 -2.518660 0.265604
C -3.160215 -1.200529 0.040059
C -3.283105 1.607371 -0.277236
C 1.936006 -2.385920 0.144888
C 0.756350 -3.147475 0.325860
C -4.396814 -0.554187 -0.103090
C -4.464316 0.858972 -0.267615
H -0.867470 2.836602 -0.072632
H -1.390544 -3.135574 0.335741
H -3.154026 -2.287031 0.160755
H -3.313972 2.696740 -0.389342
H 2.921792 -2.856204 0.100966
H 0.824338 -4.230583 0.462651
H -5.320008 -1.143195 -0.089578
H -5.435060 1.352105 -0.379902


