%chk=000175015.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000175015

0 1
 O   -3.700000     -0.3026000      -1.190400    
 O   -3.095100      -3.789500     -0.7129000    
 O   -5.152300      -2.080900     -0.9522000    
 O    8.238000      -1.127300      9.4800003E-02
 O    8.856500      0.9788000      0.1176000    
 N   -3.499000       2.405900     -0.3364000    
 N    1.852900      0.8296000      0.1298000    
 N    2.598700       1.678600     -0.4125000    
 N   -4.821400       6.227800       2.346500    
 N    7.965800      9.7000003E-02  5.6600001E-02
 C   -4.283500       2.008400      -1.488400    
 C   -4.113300       3.228500      0.6867000    
 C   -2.150700       2.008600     -0.2190000    
 C   -4.800000      0.5919000      -1.301700    
 C   -3.737800       4.695200      0.5033000    
 C   -1.227600       2.376000      -1.198200    
 C   -1.740400       1.248600      0.8763000    
 C   0.1057000       1.983300      -1.082100    
 C  -0.4070000      0.8558000      0.9924000    
 C   0.5161000       1.223200      1.3300000E-02
 C   -4.344000       5.550700       1.534000    
 C   -4.019600      -1.622800      -1.017100    
 C   -2.753900      -2.432800     -0.9168000    
 C    3.942100       1.282800     -0.2950000    
 C   -2.215900      -4.552900      1.6700000E-02
 C    4.268100     -7.2700001E-02 -0.2472000    
 C    4.949400       2.245100     -0.2253000    
 C    6.608400      0.4968000     -5.9700001E-02
 C  -0.8524000      -4.259500     -5.5999998E-03
 C   -2.686900      -5.621800      0.7791000    
 C    5.601100     -0.4657000     -0.1295000    
 C    6.282500       1.852200     -0.1075000    
 C   4.0199999E-02  -5.035100      0.7344000    
 C   -1.794300      -6.397300       1.519200    
 C  -0.4308000      -6.103900       1.496800    
 H   -3.685800       2.066300      -2.405600    
 H   -5.132200       2.688200      -1.629800    
 H   -3.826900       2.889000       1.690200    
 H   -5.205900       3.122600      0.6504000    
 H   -5.412000      0.3107000      -2.166500    
 H   -5.413700      0.5283000     -0.3949000    
 H   -2.648100       4.813400      0.5382000    
 H   -4.055500       5.038700     -0.4886000    
 H   -1.527800       2.974300      -2.054500    
 H   -2.448100      0.9425000       1.642300    
 H   0.7873000       2.275200      -1.877100    
 H  -9.6799999E-02  0.2607000       1.847200    
 H   -2.196400      -2.333100      -1.853700    
 H   -2.190000      -2.020100     -7.1099997E-02
 H    3.516300     -0.8546000     -0.3197000    
 H    4.703800       3.303300     -0.2618000    
 H  -0.4435000      -3.452700     -0.6068000    
 H   -3.747900      -5.854800      0.8002000    
 H    5.818800      -1.530400     -0.1002000    
 H    7.040600       2.629700     -5.6299999E-02
 H    1.102600      -4.810700      0.7125000    
 H   -2.161000      -7.229800       2.112700    
 H   0.2643000      -6.708700       2.071700    


%chk=000175015-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000175015

0 1
O -3.993445 -0.158109 -2.073160
O -2.983144 -2.918483 0.039041
O -4.698171 -0.728706 0.089623
O 8.674017 0.052272 1.753859
O 8.976086 -0.318748 -0.478605
N -3.579353 2.272673 -0.380264
N 1.948184 1.308435 0.528027
N 2.708830 0.966945 -0.493423
N -6.171343 4.552498 3.138647
N 8.233757 -0.024427 0.539571
C -4.203607 2.294210 -1.715071
C -4.475697 2.542052 0.755217
C -2.215142 2.017038 -0.187032
C -4.937439 0.985353 -2.081231
C -4.463624 4.054092 1.155616
C -1.363283 1.613771 -1.274950
C -1.616793 2.146219 1.110648
C 0.000061 1.381810 -1.080570
C -0.251602 1.900332 1.298699
C 0.588143 1.524160 0.213742
C -5.401235 4.342646 2.251678
C -3.953214 -0.921309 -0.885344
C -2.849318 -1.956754 -1.038455
C 4.075408 0.740492 -0.144833
C -1.994879 -3.924536 0.120934
C 4.606425 0.811558 1.178809
C 4.932430 0.413771 -1.232917
C 6.799222 0.239697 0.301763
C -0.911226 -4.058463 -0.780724
C -2.154771 -4.829240 1.198232
C 5.967195 0.561429 1.403187
C 6.297685 0.162926 -1.018049
C 0.015652 -5.110780 -0.589559
C -1.223388 -5.871370 1.372390
C -0.132086 -6.018996 0.480200
H -3.447753 2.532359 -2.479695
H -4.952469 3.111446 -1.749627
H -4.206529 1.910197 1.617435
H -5.501574 2.249193 0.474499
H -5.325133 1.037795 -3.111855
H -5.760095 0.773399 -1.375505
H -3.444412 4.357538 1.457046
H -4.736266 4.673080 0.279619
H -1.783540 1.445057 -2.269447
H -2.216489 2.432884 1.978164
H 0.640838 1.075065 -1.913114
H 0.200914 1.997485 2.290952
H -2.935690 -2.435196 -2.034591
H -1.874577 -1.424871 -0.994015
H 3.930467 1.061743 2.001011
H 4.497693 0.365181 -2.235938
H -0.772226 -3.369227 -1.619375
H -3.002969 -4.694962 1.876220
H 6.405352 0.606453 2.403769
H 6.976877 -0.088619 -1.836338
H 0.856571 -5.213940 -1.284360
H -1.348128 -6.569136 2.207660
H 0.590503 -6.829380 0.620586


