%chk=000134111.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134111

0 1
 O    2.223700      -3.025600      0.1104000    
 O   -2.730400       1.432500      0.5138000    
 O    4.085700       2.789200      0.1100000    
 O    5.310100      -1.626200      0.5026000    
 O  -0.1268000      -4.102600       1.134600    
 N    3.342000      -1.114600     -0.6407000    
 N    4.687300      0.5719000      0.2999000    
 C    1.713200       2.225300      -1.358900    
 C    2.655700       1.170700     -0.8747000    
 C   0.6347000       2.540300     -0.3579000    
 C    2.474100     -0.1387000      -1.086100    
 C    3.860000       1.603600     -0.1172000    
 C  -0.5579000       1.830600     -0.3914000    
 C    3.016400      -2.503200     -0.9450000    
 C    4.500600     -0.7976000      8.0899999E-02
 C   0.8472000       3.535900      0.5859000    
 C   -1.557400       2.122300      0.5369000    
 C  -0.1521000       3.827500       1.514100    
 C   -1.354300       3.120600       1.489800    
 C   -2.871700      0.4251000     -0.4867000    
 C   -4.233200     -0.1946000     -0.3691000    
 C    1.898300      -4.391600     -0.1089000    
 C    1.053900      -4.891000       1.047500    
 C   -4.417000      -1.301700      0.4519000    
 C   -5.298800      0.3442000      -1.081400    
 C   -5.682600      -1.877700      0.5615000    
 C   -6.564400     -0.2318000     -0.9716000    
 C   -6.756300      -1.342800     -0.1501000    
 H    2.254700       3.141200      -1.629600    
 H    1.248100       1.906400      -2.302300    
 H    1.604300     -0.4916000      -1.631700    
 H  -0.6565000       1.064800      -1.152600    
 H    3.946500      -3.078300      -1.022500    
 H    2.483100      -2.566400      -1.901300    
 H    1.774900       4.099700      0.6125000    
 H    5.518700      0.8375000      0.8204000    
 H   5.2000000E-03   4.606000       2.255000    
 H   -2.129200       3.352400       2.215300    
 H   -2.775900      0.8554000      -1.492500    
 H   -2.115800     -0.3611000     -0.3571000    
 H    2.813800      -4.988100     -0.1870000    
 H    1.330500      -4.473700      -1.043000    
 H   0.7666000      -5.936000      0.9026000    
 H    1.589200      -4.796500       1.997400    
 H   -3.588400      -1.725400       1.012700    
 H   -5.161800       1.210800      -1.722200    
 H   -5.832300      -2.742200       1.201600    
 H   -7.400800      0.1850000      -1.525200    
 H   -7.741900      -1.791000     -6.4400002E-02
 H   0.1478000      -3.176600       1.248100    


%chk=000134111-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000134111

0 1
O 2.325735 -2.893213 0.321686
O -2.695690 1.083773 0.498543
O 4.334982 2.889809 -0.094214
O 5.813857 -1.446297 0.828821
O -0.363420 -1.999293 -0.094700
N 3.813426 -1.182530 -0.398805
N 5.030899 0.703044 0.320505
C 1.878571 1.969015 -1.461837
C 2.954695 1.050055 -0.904752
C 0.772673 2.242912 -0.435825
C 2.865403 -0.318903 -0.959292
C 4.112778 1.650440 -0.220812
C -0.443989 1.514306 -0.498195
C 3.561948 -2.629501 -0.416169
C 4.952221 -0.696320 0.296909
C 0.974775 3.189871 0.596063
C -1.455058 1.737332 0.472015
C -0.039800 3.402449 1.560689
C -1.249569 2.684861 1.507716
C -2.967756 0.083835 -0.575001
C -4.313778 -0.537234 -0.286941
C 1.347920 -3.767891 -0.352249
C -0.020293 -3.392461 0.219804
C -4.395874 -1.734217 0.467968
C -5.508547 0.064329 -0.755095
C -5.649774 -2.319683 0.752665
C -6.764528 -0.517753 -0.473001
C -6.837284 -1.712277 0.281474
H 2.360519 2.920070 -1.750146
H 1.442446 1.520349 -2.373100
H 2.015391 -0.814996 -1.437495
H -0.597164 0.795258 -1.310204
H 4.419672 -3.111190 0.080849
H 3.462587 -2.979522 -1.463732
H 1.917338 3.745839 0.641397
H 5.847047 1.089291 0.806261
H 0.114008 4.136679 2.359434
H -2.045817 2.839975 2.242131
H -2.967506 0.612563 -1.550209
H -2.167736 -0.681036 -0.565166
H 1.578713 -4.835591 -0.157553
H 1.363679 -3.586134 -1.448060
H -0.805532 -4.008657 -0.249199
H -0.030446 -3.566041 1.314284
H -3.471716 -2.197933 0.833614
H -5.452391 0.993535 -1.334983
H -5.702836 -3.244164 1.338776
H -7.682280 -0.044025 -0.839024
H -7.810916 -2.165614 0.499912
H 0.259218 -1.404818 0.398546


