%chk=000135844.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135844

0 1
 O   0.4924000      0.9340000     -0.5983000    
 O   -4.336500      -1.001800      0.6225000    
 O    1.982300      -1.363900      -1.789200    
 N    2.474800      -1.156800      0.4672000    
 N    5.308400       1.227700      7.0799999E-02
 C  -0.8133000     -0.9859000     -0.1302000    
 C   -2.079000      -1.482700      0.1882000    
 C   0.2669000      -1.865300     -0.2714000    
 C   -1.751500       1.380700     -0.1667000    
 C   -3.017100      0.8839000      0.1519000    
 C  -0.6034000      0.4639000     -0.3195000    
 C   -3.227000     -0.5660000      0.3415000    
 C    3.840700     -0.7148000      0.3006000    
 C    3.921700      0.8019000      0.2095000    
 C    1.627200      -1.455300     -0.6033000    
 C   -2.264600      -2.859200      0.3649000    
 C   7.7500001E-02  -3.236300     -9.4099998E-02
 C   -1.185400      -3.732100      0.2234000    
 C   -1.565900       2.757100     -0.3432000    
 C   -4.097100       1.763500      0.2938000    
 C   -2.644700       3.630200     -0.2003000    
 C   -3.907700       3.134400      0.1172000    
 C    6.108500      0.7575000       1.203400    
 C    5.392700       2.685300     -3.8899999E-02
 H    4.362000      -1.113700       1.174900    
 H    4.261000      -1.184000     -0.5963000    
 H    3.345400       1.135000     -0.6630000    
 H    3.448300       1.254800       1.091400    
 H   -3.239200      -3.270900      0.6129000    
 H   0.9060000      -3.932600     -0.2009000    
 H    2.114300      -1.237300       1.413800    
 H   -1.330300      -4.799800      0.3607000    
 H  -0.5922000       3.170900     -0.5913000    
 H   -5.091600       1.402000      0.5412000    
 H   -2.499900       4.697900     -0.3371000    
 H   -4.746000       3.816200      0.2276000    
 H    6.295900     -0.3194000       1.152800    
 H    5.654000       1.003900       2.170000    
 H    7.105400       1.214900       1.181100    
 H    6.429000       3.000500     -0.2047000    
 H    5.016800       3.189900      0.8586000    
 H    4.817100       3.040100     -0.9012000    


%chk=000135844-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000135844

0 1
O 0.601629 0.977813 -0.093889
O -4.500974 -1.051341 0.377688
O 2.095618 -1.368619 -1.725419
N 2.530291 -1.324356 0.567704
N 5.391132 1.157092 0.171884
C -0.817438 -0.978615 -0.060687
C -2.144447 -1.491132 0.088706
C 0.270000 -1.888996 -0.214311
C -1.762277 1.404946 0.041699
C -3.083507 0.889013 0.175492
C -0.576045 0.498435 -0.044823
C -3.327926 -0.582199 0.227082
C 3.918426 -0.849464 0.422600
C 3.991096 0.693069 0.284576
C 1.698321 -1.459424 -0.523512
C -2.374774 -2.886827 0.103812
C 0.014348 -3.281850 -0.206823
C -1.296751 -3.781300 -0.038792
C -1.559309 2.806580 -0.003056
C -4.182319 1.778909 0.264562
C -2.657028 3.685883 0.081767
C -3.972049 3.171146 0.216666
C 6.096586 1.210995 1.466586
C 5.525854 2.418133 -0.584239
H 4.499324 -1.203420 1.293059
H 4.347030 -1.300944 -0.486995
H 3.443556 0.970212 -0.632105
H 3.449878 1.173242 1.139458
H -3.404269 -3.238085 0.223029
H 0.851251 -3.974404 -0.346154
H 2.103040 -1.312709 1.495796
H -1.471470 -4.862023 -0.030460
H -0.534987 3.177671 -0.106365
H -5.185104 1.352976 0.369260
H -2.495392 4.768316 0.042864
H -4.823475 3.856708 0.282829
H 6.059166 0.228499 1.968952
H 5.667942 1.972889 2.168383
H 7.160208 1.459752 1.300547
H 6.596955 2.648794 -0.731867
H 5.052931 3.297112 -0.076242
H 5.060859 2.305922 -1.578959


