%chk=000148882.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148882

0 1
 O    3.301700     -0.1158000      -1.588100    
 N   5.8499999E-02  1.3300000E-02  0.8311000    
 C   0.6209000      -1.250100      0.5382000    
 C   0.7171000       1.228400      0.5352000    
 C   -1.237400      6.4099997E-02   1.514100    
 C    1.767100      -1.326900     -0.2770000    
 C    1.865800       1.214000     -0.2800000    
 C    2.379400     -7.8900002E-02 -0.7837000    
 C   -2.360100      7.9000004E-02  0.5141000    
 C   0.1099000      -2.465000       1.030500    
 C   0.3019000       2.480600       1.024300    
 C    2.353400      -2.555300     -0.6138000    
 C    2.545500       2.392300     -0.6202000    
 C   0.6940000      -3.693100      0.7009000    
 C   0.9795000       3.658700      0.6913000    
 C    1.810700      -3.738500     -0.1249000    
 C    2.096300       3.615200     -0.1345000    
 C   -2.907700      -1.121400      8.0200002E-02
 C   -2.836100       1.293100      3.5799999E-02
 C   -3.949100      -1.107500     -0.8478000    
 C   -3.877600       1.307000     -0.8919000    
 C   -4.434200      0.1068000      -1.333700    
 H   -1.340000      0.9142000       2.195600    
 H   -1.383300     -0.7569000       2.223800    
 H  -0.7399000      -2.520900       1.700500    
 H  -0.5467000       2.606000       1.686300    
 H    3.235100      -2.606400      -1.246700    
 H    3.428400       2.373300      -1.253300    
 H   0.2751000      -4.614100       1.096700    
 H   0.6320000       4.610700       1.082700    
 H    2.263000      -4.692300     -0.3791000    
 H    2.620800       4.530500     -0.3915000    
 H   -2.567400      -2.078700      0.4564000    
 H   -2.431900       2.240000      0.3755000    
 H   -4.386100      -2.041700      -1.188000    
 H   -4.258100       2.252400      -1.267500    
 H   -5.246400      0.1176000      -2.054500    


%chk=000148882-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000148882

0 1
O 4.082016 0.148649 -0.716694
N 0.137820 -0.066165 0.688491
C 0.766301 -1.237718 0.207642
C 0.752885 1.198327 0.541724
C -1.136321 -0.175834 1.429832
C 2.112946 -1.186308 -0.279750
C 2.099751 1.294954 0.061613
C 2.863678 0.089184 -0.333330
C -2.409246 -0.079646 0.584299
C 0.079455 -2.489142 0.196954
C 0.051781 2.399627 0.863955
C 2.743816 -2.377111 -0.728870
C 2.717325 2.569315 -0.049097
C 0.727379 -3.650736 -0.254414
C 0.686730 3.646622 0.743237
C 2.070998 -3.606829 -0.713391
C 2.030963 3.742438 0.294148
C -3.666870 -0.241284 1.220306
C -2.368878 0.172635 -0.806965
C -4.864050 -0.150302 0.477650
C -3.567311 0.262836 -1.552192
C -4.817725 0.102721 -0.913995
H -1.143919 0.610531 2.205993
H -1.126611 -1.132425 1.982728
H -0.969440 -2.553019 0.497082
H -0.998222 2.370415 1.166051
H 3.775159 -2.283548 -1.085173
H 3.749384 2.585416 -0.415112
H 0.177343 -4.598448 -0.261588
H 0.125604 4.555318 0.988566
H 2.566103 -4.519018 -1.060957
H 2.515876 4.719741 0.206226
H -3.711168 -0.438901 2.299479
H -1.402698 0.297334 -1.307188
H -5.828991 -0.277109 0.981162
H -3.522128 0.458155 -2.629291
H -5.745634 0.173025 -1.492133


