%chk=000127153.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127153

0 1
 O    2.015900      -2.873700     -0.5857000    
 N   -2.324100      5.2000000E-03  0.6484000    
 N    3.092300       2.456300      0.1437000    
 C  -0.9809000      0.3090000      0.1575000    
 C  -0.4360000       1.588900      0.8768000    
 C  -6.8800002E-02 -0.9573000      0.3017000    
 C    1.004100       1.793000      0.5433000    
 C    1.366000     -0.6356000     -3.1300001E-02
 C    1.780900      0.6906000      0.1313000    
 C   -2.851500      -1.188300     -1.1800000E-02
 C   -3.215900       1.144200      0.4345000    
 C    3.075600       1.102600     -0.1148000    
 C    1.841100       2.883900      0.5455000    
 C    2.335300      -1.557500     -0.4330000    
 C   -4.239600      -1.522800      0.5282000    
 C   -3.278500       1.496900      -1.049500    
 C    4.053500      0.1993000     -0.5338000    
 C    3.652300      -1.141000     -0.6837000    
 C   -4.802400      -2.774300     -0.1279000    
 C   -4.183900       2.693600      -1.296800    
 C    2.164500      -3.712900      0.5574000    
 H  -0.9666000      0.5038000     -0.9227000    
 H  -0.5357000       1.489200       1.965000    
 H  -0.9679000       2.492300      0.5610000    
 H  -0.3799000      -1.740300     -0.3980000    
 H  -0.1096000      -1.351200       1.324500    
 H   -2.848300      -1.133800      -1.106100    
 H   -2.252100      -2.065400      0.2544000    
 H   -4.218000      0.9774000      0.8399000    
 H   -2.894500       2.013300       1.019100    
 H    1.674400       3.922600      0.7935000    
 H    3.903200       3.052800      5.6200001E-02
 H   -4.207200      -1.665500       1.615000    
 H   -4.972700     -0.7402000      0.3155000    
 H   -2.311200       1.786400      -1.466600    
 H   -3.673800      0.6765000      -1.655400    
 H    5.073900      0.5082000     -0.7295000    
 H    4.393400      -1.872100      -1.002000    
 H   -4.889500      -2.645200      -1.211600    
 H   -4.161600      -3.640800      6.4700000E-02
 H   -5.798400      -2.996200      0.2685000    
 H   -5.205900       2.487600     -0.9625000    
 H   -3.819800       3.578300     -0.7643000    
 H   -4.219000       2.931600      -2.364800    
 H    1.530700      -3.365800       1.379200    
 H    3.211000      -3.742000      0.8773000    
 H    1.855200      -4.724800      0.2817000    


%chk=000127153-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127153

0 1
O 2.173346 -3.027247 -0.374850
N -2.309667 -0.031147 0.448354
N 3.217878 2.476080 -0.101680
C -0.899981 0.261521 0.014100
C -0.380717 1.588482 0.669467
C 0.024047 -0.957046 0.369867
C 1.080443 1.795467 0.352360
C 1.490020 -0.694444 0.069919
C 1.904633 0.651642 0.085132
C -2.885370 -1.218916 -0.248123
C -3.226372 1.143571 0.433271
C 3.233989 1.076260 -0.203327
C 1.910129 2.908280 0.228913
C 2.484715 -1.638930 -0.256373
C -4.293994 -1.623259 0.238329
C -3.528053 1.788742 -0.950429
C 4.226642 0.121554 -0.528596
C 3.825428 -1.233530 -0.546219
C -4.701485 -3.006943 -0.314653
C -4.468799 3.005223 -0.813921
C 2.071512 -3.730882 0.914188
H -0.841760 0.400455 -1.097059
H -0.543793 1.509777 1.764702
H -0.975042 2.448537 0.313528
H -0.287585 -1.859328 -0.183626
H -0.129569 -1.169897 1.448912
H -2.910699 -1.080410 -1.360543
H -2.221496 -2.079908 -0.058788
H -4.181394 0.829883 0.893179
H -2.819569 1.917017 1.108836
H 1.692676 3.968942 0.343979
H 4.012321 3.092554 -0.254259
H -4.294573 -1.642372 1.345789
H -5.048587 -0.875781 -0.074140
H -2.580788 2.102062 -1.432473
H -3.987699 1.037697 -1.622648
H 5.259074 0.399010 -0.766692
H 4.544079 -2.017952 -0.806806
H -4.680864 -3.016455 -1.421144
H -4.012749 -3.796555 0.040136
H -5.723269 -3.280512 0.005369
H -5.434677 2.712403 -0.359358
H -4.020156 3.784413 -0.168193
H -4.684811 3.464880 -1.795586
H 1.273255 -3.300033 1.550451
H 3.033160 -3.689699 1.463760
H 1.826177 -4.776405 0.668944


